N-(4-chloranyl-2-methyl-phenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-2-[[4-(p-tolyl)-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-chloro-2-methylphenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-chloro-2-methylphenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-2-[[4-(p-tolyl)-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H21ClN4OS2 MolecularWeight: 469.02204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)Cl)C)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)Cl)C)CC4=CC=CS4

InChI

InChI=1S/C23H21ClN4OS2/c1-15-5-8-18(9-6-15)28-21(13-19-4-3-11-30-19)26-27-23(28)31-14-22(29)25-20-10-7-17(24)12-16(20)2/h3-12H,13-14H2,1-2H3,(H,25,29)