N-cyclohexyl-N-methyl-2-[5-(3-nitrophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-cyclohexyl-N-methyl-2-[5-(3-nitrophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-cyclohexyl-N-methyl-2-[5-(3-nitrophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-cyclohexyl-N-methyl-2-[5-(3-nitrophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-cyclohexyl-N-methyl-2-[5-(3-nitrophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-cyclohexyl-2-[4-keto-5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-3-yl]-N-methyl-acetamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O4S/c1-23(15-7-3-2-4-8-15)18(26)11-24-13-22-20-19(21(24)27)17(12-30-20)14-6-5-9-16(10-14)25(28)29/h5-6,9-10,12-13,15H,2-4,7-8,11H2,1H3