(3S)-3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)-N-(phenylmethyl)piperidine-1-carboxamide

Systemtic Name: (3S)-3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)-N-(phenylmethyl)piperidine-1-carboxamide Openeye Name: (3S)-N-benzyl-3-(4-isopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide CAS Name: (3S)-3-[5-(methylthio)-4-propan-2-yl-1,2,4-triazol-3-yl]-N-(phenylmethyl)-1-piperidinecarboxamide IUPAC Name: (3S)-N-benzyl-3-(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)piperidine-1-carboxamide Traditional Name: (3S)-N-benzyl-3-[4-isopropyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidine-1-carboxamide Formula: C19H27N5OS MolecularWeight: 373.51558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC)C2CCCN(C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=NN=C1SC)[C@H]2CCCN(C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H27N5OS/c1-14(2)24-17(21-22-19(24)26-3)16-10-7-11-23(13-16)18(25)20-12-15-8-5-4-6-9-15/h4-6,8-9,14,16H,7,10-13H2,1-3H3,(H,20,25)/t16-/m0/s1