2-[2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[[2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-phenethyl-benzamide Formula: C27H27N5O2S MolecularWeight: 485.60058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O2S/c1-19-10-6-7-13-21(19)25-30-31-27(32(25)2)35-18-24(33)29-23-15-9-8-14-22(23)26(34)28-17-16-20-11-4-3-5-12-20/h3-15H,16-18H2,1-2H3,(H,28,34)(H,29,33)