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

Systemtic Name: N-cyclopropyl-2-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C21H21N5O2S/c1-14-6-2-5-9-18(14)26-13-22-25-21(26)29-12-19(27)24-17-8-4-3-7-16(17)20(28)23-15-10-11-15/h2-9,13,15H,10-12H2,1H3,(H,23,28)(H,24,27)