2-{11-methyl-3-oxo-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-5-yl}acetonitrile, 95%

cas: 728908-00-7 — see every product listed under this CAS number, including other names

2-{11-methyl-3-oxo-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-5-yl}acetonitrile, 95% (CAS 728908-00-7) is a chemical reagent available from Chemat. Available pack sizes: 5g. Offered by: AmBeed.

• 2D
• 3D

2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)acetonitrile (CAS 728908-00-7) is a chemical compound with the molecular formula C13H13N3OS and a molecular weight of 259.33 g/mol. IUPAC name: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)acetonitrile. InChIKey: DTZPAZOQQCABIG-UHFFFAOYSA-N.

Identity

Molecular formula	C13H13N3OS
Molecular weight	259.33 g/mol
IUPAC name	2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)acetonitrile
InChIKey	DTZPAZOQQCABIG-UHFFFAOYSA-N
SMILES	CC1CCC2=C(C1)SC3=C2C(=O)NC(=N3)CC#N

Computed by PubChem (NCBI)

Isomers (same molecular formula)

(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-phenylmethanone C₁₃H₁₃N₃OS

1-[(E)-furan-2-ylmethylideneamino]-3-(3-methylphenyl)thiourea C₁₃H₁₃N₃OS

2-amino-7-(5-methylthiophen-2-yl)-7,8-dihydro-6H-quinazolin-5-one C₁₃H₁₃N₃OS

1-amino-3-(4-phenoxyphenyl)thiourea C₁₃H₁₃N₃OS

3-(3-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-6-yl)propan-1-ol C₁₃H₁₃N₃OS

N-[(Z)-1-(3-aminophenyl)ethylideneamino]thiophene-2-carboxamide C₁₃H₁₃N₃OS

N-(6-methylsulfanylpyridazin-3-yl)-2-phenylacetamide C₁₃H₁₃N₃OS

N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1,3-benzoxazol-2-amine C₁₃H₁₃N₃OS

1-(4-methoxyphenyl)-3-pyridin-2-ylthiourea C₁₃H₁₃N₃OS

5-(1H-indol-3-ylmethyl)-3-methyl-2-sulfanylideneimidazolidin-4-one C₁₃H₁₃N₃OS

6-(2-amino-5-methyl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one C₁₃H₁₃N₃OS

1-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyrrolidin-2-one C₁₃H₁₃N₃OS