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

Systemtic Name: 2-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-N-phenethyl-benzamide Openeye Name: N-phenethyl-2-[[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-phenethylbenzamide Traditional Name: N-phenethyl-2-[[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H25N5O2S/c1-18-11-13-20(14-12-18)24-29-26(31-30-24)34-17-23(32)28-22-10-6-5-9-21(22)25(33)27-16-15-19-7-3-2-4-8-19/h2-14H,15-17H2,1H3,(H,27,33)(H,28,32)(H,29,30,31)