4-[[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]methyl]benzamide

Systemtic Name: 4-[[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]methyl]benzamide Openeye Name: 4-[[[2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]methyl]benzamide CAS Name: 4-[[[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxoethyl]amino]methyl]benzamide IUPAC Name: 4-[[[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetyl]amino]methyl]benzamide Traditional Name: 4-[[[2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]methyl]benzamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C19H19N5O2S/c1-12-2-6-15(7-3-12)18-22-23-19(27)24(18)11-16(25)21-10-13-4-8-14(9-5-13)17(20)26/h2-9H,10-11H2,1H3,(H2,20,26)(H,21,25)(H,23,27)