ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

cas: 85716-87-6 — see every product listed under this CAS number, including other names

ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 85716-87-6) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g, 10g. Offered by: Fluorochem.

• 2D
• 3D

Ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 85716-87-6) is a chemical compound with the molecular formula C12H13NO2S2 and a molecular weight of 267.4 g/mol. IUPAC name: ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate. InChIKey: UGKJYSQOLXXTJG-UHFFFAOYSA-N.

Identity

Molecular formula	C12H13NO2S2
Molecular weight	267.4 g/mol
IUPAC name	ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
InChIKey	UGKJYSQOLXXTJG-UHFFFAOYSA-N
SMILES	CCOC(=O)C1=C(SC2=C1CCCC2)N=C=S

Computed by PubChem (NCBI)

Synonyms: ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, UGKJYSQOLXXTJG-UHFFFAOYSA-N, ethyl 4,5,6,7-tetrahydro-2-isothiocyanatobenzo[b]thiophene-3-carboxylate, 3-ethoxycarbonyl-2-isothiocyanato-4,5,6,7-tetrahydrobenzo[b]thiophene, ethyl 2-isothiocyanato-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-isothiocyanato-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate

Isomers (same molecular formula)

6,6-dimethyl-3-methylsulfinyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile C₁₂H₁₃NO₂S₂

(4-ethoxyphenyl)-(2-sulfanylidene-1,3-thiazolidin-3-yl)methanone C₁₂H₁₃NO₂S₂

ethyl 2-amino-4-(5-methylthiophen-2-yl)thiophene-3-carboxylate C₁₂H₁₃NO₂S₂

methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate C₁₂H₁₃NO₂S₂

methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate C₁₂H₁₃NO₂S₂

4-methyl-N-(thiophen-2-ylmethyl)benzenesulfonamide C₁₂H₁₃NO₂S₂

2-(1,3-benzothiazol-2-ylsulfanyl)-3-methylbutanoic acid C₁₂H₁₃NO₂S₂

1-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-hydroxyphenyl]ethanone C₁₂H₁₃NO₂S₂

ethyl 2-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)acetate C₁₂H₁₃NO₂S₂

2-(benzenesulfonyl)-2-thiophen-2-ylethanamine C₁₂H₁₃NO₂S₂