N-[[2-[(2-methylphenyl)carbamoyl]phenyl]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[2-[(2-methylphenyl)carbamoyl]phenyl]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[2-(o-tolylcarbamoyl)phenyl]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[2-[(2-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[2-[(2-methylphenyl)carbamoyl]phenyl]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[2-(o-tolylcarbamoyl)phenyl]thiocarbamoyl]nicotinamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H18N4O2S/c1-14-7-2-4-10-17(14)23-20(27)16-9-3-5-11-18(16)24-21(28)25-19(26)15-8-6-12-22-13-15/h2-13H,1H3,(H,23,27)(H2,24,25,26,28)