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

Systemtic Name: 4-chloranyl-N-(2-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(2-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-(2-methyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(4-keto-2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-benzamide Formula: C20H13ClN4O4S MolecularWeight: 440.85962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H13ClN4O4S/c1-11-22-19-17(14(10-30-19)12-5-3-2-4-6-12)20(27)24(11)23-18(26)13-7-8-15(21)16(9-13)25(28)29/h2-10H,1H3,(H,23,26)