N-[(4-methylphenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-[(4-methylphenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(p-tolylcarbamoyl)propanamide CAS Name: N-[(4-methylanilino)-oxomethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(4-methylphenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-(p-tolylcarbamoyl)propionamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H19N5O2S/c1-13-8-10-15(11-9-13)21-18(26)22-17(25)14(2)27-19-20-12-24(23-19)16-6-4-3-5-7-16/h3-12,14H,1-2H3,(H2,21,22,25,26)