2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylphenyl)propanamide

Systemtic Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylphenyl)propanamide Openeye Name: 2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)propanamide CAS Name: 2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylphenyl)propanamide IUPAC Name: 2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylphenyl)propanamide Traditional Name: 2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]-N-(2-phenylphenyl)propionamide Formula: C25H29N5OS MolecularWeight: 447.59566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NN=C(N3C4CC4)N5CCCCC5

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NN=C(N3C4CC4)N5CCCCC5

InChI

InChI=1S/C25H29N5OS/c1-18(23(31)26-22-13-7-6-12-21(22)19-10-4-2-5-11-19)32-25-28-27-24(30(25)20-14-15-20)29-16-8-3-9-17-29/h2,4-7,10-13,18,20H,3,8-9,14-17H2,1H3,(H,26,31)