2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-methylphenyl)-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-methylphenyl)-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2,6-dioxo-3-(p-tolyl)pyrimidin-4-yl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-(4-methylphenyl)-2,6-dioxo-4-pyrimidinyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-methylphenyl)-2,6-dioxopyrimidin-4-yl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[2,6-diketo-3-(p-tolyl)pyrimidin-4-yl]acetamide Formula: C20H17N5O3S MolecularWeight: 407.44568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H17N5O3S/c1-12-6-8-13(9-7-12)25-16(10-17(26)24-20(25)28)23-18(27)11-29-19-21-14-4-2-3-5-15(14)22-19/h2-10H,11H2,1H3,(H,21,22)(H,23,27)(H,24,26,28)