N-(4-methyl-2-oxidanyl-phenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(4-methyl-2-oxidanyl-phenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(2-hydroxy-4-methyl-phenyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(2-hydroxy-4-methylphenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(2-hydroxy-4-methylphenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(2-hydroxy-4-methyl-phenyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCN2C(=NNC2=S)C3=CC(=CC=C3)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCN2C(=NNC2=S)C3=CC(=CC=C3)C)O

InChI

InChI=1S/C19H20N4O2S/c1-12-4-3-5-14(10-12)18-21-22-19(26)23(18)9-8-17(25)20-15-7-6-13(2)11-16(15)24/h3-7,10-11,24H,8-9H2,1-2H3,(H,20,25)(H,22,26)