N-cyclopentyl-2-[[4-(3-methylphenyl)-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclopentyl-2-[[4-(3-methylphenyl)-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(anilinomethyl)-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[5-(anilinomethyl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[5-(anilinomethyl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[[5-(anilinomethyl)-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-acetamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3CCCC3)CNC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3CCCC3)CNC4=CC=CC=C4

InChI

InChI=1S/C23H27N5OS/c1-17-8-7-13-20(14-17)28-21(15-24-18-9-3-2-4-10-18)26-27-23(28)30-16-22(29)25-19-11-5-6-12-19/h2-4,7-10,13-14,19,24H,5-6,11-12,15-16H2,1H3,(H,25,29)