N-(cyclopentylcarbamoyl)-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(cyclopentylcarbamoyl)-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(cyclopentylcarbamoyl)-3-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(cyclopentylcarbamoyl)-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(cyclopentylcarbamoyl)-3-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)NC(=O)NC3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)NC(=O)NC3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O2S/c1-17-11-13-20(14-12-17)29-22(18-7-3-2-4-8-18)27-28-24(29)32-16-15-21(30)26-23(31)25-19-9-5-6-10-19/h2-4,7-8,11-14,19H,5-6,9-10,15-16H2,1H3,(H2,25,26,30,31)