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

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

C1CCN(CC1)C2=NN=C(N2C3CC3)SCCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C25H29N5OS/c31-23(26-22-12-6-5-11-21(22)19-9-3-1-4-10-19)15-18-32-25-28-27-24(30(25)20-13-14-20)29-16-7-2-8-17-29/h1,3-6,9-12,20H,2,7-8,13-18H2,(H,26,31)