N-(4-acetamidophenyl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-(4-methyl-6-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetamidophenyl)-2-[(4-methyl-6-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(4-methyl-6-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(6-keto-4-methyl-1-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=CC=C(C=C2)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=CC=C(C=C2)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C21H20N4O3S/c1-14-12-20(28)25(18-6-4-3-5-7-18)21(22-14)29-13-19(27)24-17-10-8-16(9-11-17)23-15(2)26/h3-12H,13H2,1-2H3,(H,23,26)(H,24,27)