2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethylphenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethylphenyl)-2-phenyl-ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,5-dimethylphenyl)-2-phenyl-acetamide CAS Name: 2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-(3,5-dimethylphenyl)-2-phenylacetamide IUPAC Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethylphenyl)-2-phenylacetamide Traditional Name: 2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]-N-(3,5-dimethylphenyl)-2-phenyl-acetamide Formula: C26H31N5OS MolecularWeight: 461.62224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4CC4)N5CCCCC5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4CC4)N5CCCCC5)C

InChI

InChI=1S/C26H31N5OS/c1-18-15-19(2)17-21(16-18)27-24(32)23(20-9-5-3-6-10-20)33-26-29-28-25(31(26)22-11-12-22)30-13-7-4-8-14-30/h3,5-6,9-10,15-17,22-23H,4,7-8,11-14H2,1-2H3,(H,27,32)