N-(2-chloranyl-5-nitro-phenyl)-2-(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(3-methyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(3-methyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(3-methyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(4-keto-3-methyl-thieno[3,2-d]pyrimidin-2-yl)thio]propionamide Formula: C16H13ClN4O4S2 MolecularWeight: 424.88182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN4O4S2/c1-8(14(22)18-12-7-9(21(24)25)3-4-10(12)17)27-16-19-11-5-6-26-13(11)15(23)20(16)2/h3-8H,1-2H3,(H,18,22)