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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]-2-phenyl-acetamide Formula: C25H28ClN5OS MolecularWeight: 482.04072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28ClN5OS/c1-17-10-11-19(16-21(17)26)27-23(32)22(18-8-4-2-5-9-18)33-25-29-28-24(31(25)20-12-13-20)30-14-6-3-7-15-30/h2,4-5,8-11,16,20,22H,3,6-7,12-15H2,1H3,(H,27,32)