2-(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=C(C(=O)N2C)SC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=C(C(=O)N2C)SC=C3

InChI

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