4-(2-Methoxyethyl)-5-sulfanyl-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-3-one

cas: 748777-74-4 — see every product listed under this CAS number, including other names

4-(2-Methoxyethyl)-5-sulfanyl-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-3-one (CAS 748777-74-4) is a chemical reagent available from Chemat. Available pack sizes: 0,5g, 5g. Offered by: Biosynth.

• 2D
• 3D

3-(2-methoxyethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one (CAS 748777-74-4) is a chemical compound with the molecular formula C13H16N2O2S2 and a molecular weight of 296.4 g/mol. IUPAC name: 3-(2-methoxyethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one. InChIKey: VMMGCORBXAPZFZ-UHFFFAOYSA-N.

Identity

Molecular formula	C13H16N2O2S2
Molecular weight	296.4 g/mol
IUPAC name	3-(2-methoxyethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
InChIKey	VMMGCORBXAPZFZ-UHFFFAOYSA-N
SMILES	COCCN1C(=O)C2=C(NC1=S)SC3=C2CCCC3

Computed by PubChem (NCBI)

Synonyms: cid_2376086, REGID_for_CID_2376086

Isomers (same molecular formula)

1-(4-isothiocyanatophenyl)sulfonyl-2-methylpiperidine C₁₃H₁₆N₂O₂S₂

1-(4-isothiocyanatophenyl)sulfonylazepane C₁₃H₁₆N₂O₂S₂

1-(4-isothiocyanatophenyl)sulfonyl-4-methylpiperidine C₁₃H₁₆N₂O₂S₂

N-cyclohexyl-4-isothiocyanatobenzenesulfonamide C₁₃H₁₆N₂O₂S₂

11-(3-methoxypropyl)-10-sulfanylidene-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-dien-12-one C₁₃H₁₆N₂O₂S₂

propan-2-yl 6-methyl-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate C₁₃H₁₆N₂O₂S₂