N-(2-methyl-3-nitro-phenyl)-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C16H14N4O4S2 MolecularWeight: 390.43676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CSC2=NC3=C(C=CS3)C(=O)N2C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CSC2=NC3=C(C=CS3)C(=O)N2C

InChI

InChI=1S/C16H14N4O4S2/c1-9-11(4-3-5-12(9)20(23)24)17-13(21)8-26-16-18-14-10(6-7-25-14)15(22)19(16)2/h3-7H,8H2,1-2H3,(H,17,21)