2-[[4-phenyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide

Systemtic Name: 2-[[4-phenyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Openeye Name: 2-[[4-phenyl-5-(1-piperidylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide CAS Name: 2-[[4-phenyl-5-(1-piperidinylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-[[4-phenyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Traditional Name: 2-[[4-phenyl-5-(piperidinomethyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propionamide Formula: C26H33N5OS MolecularWeight: 463.63812

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NN=C(N1C2=CC=CC=C2)CN3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NN=C(N1C2=CC=CC=C2)CN3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N5OS/c1-20(22-12-6-3-7-13-22)18-27-25(32)21(2)33-26-29-28-24(19-30-16-10-5-11-17-30)31(26)23-14-8-4-9-15-23/h3-4,6-9,12-15,20-21H,5,10-11,16-19H2,1-2H3,(H,27,32)