N-ethyl-3-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-ethyl-3-[[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2C3=CC=CC=C3C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2C3=CC=CC=C3C

InChI

InChI=1S/C20H21N5O2S/c1-3-21-19(27)15-8-6-9-16(11-15)23-18(26)12-28-20-24-22-13-25(20)17-10-5-4-7-14(17)2/h4-11,13H,3,12H2,1-2H3,(H,21,27)(H,23,26)