N-(4-methyl-2-nitro-phenyl)-2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4S/c1-13-7-8-16(17(9-13)25(28)29)23-19(26)11-24-12-22-20-15(21(24)27)10-18(30-20)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,23,26)