3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N'-(2-phenylethanoyl)propanehydrazide

Systemtic Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N'-(2-phenylethanoyl)propanehydrazide Openeye Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N'-(2-phenylacetyl)propanehydrazide CAS Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N'-(1-oxo-2-phenylethyl)propanehydrazide IUPAC Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N'-(2-phenylacetyl)propanehydrazide Traditional Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N'-(2-phenylacetyl)propionohydrazide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O2S/c1-14-6-5-9-16(12-14)19-23-24-20(28)25(19)11-10-17(26)21-22-18(27)13-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,21,26)(H,22,27)(H,24,28)