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

Systemtic Name: (3S)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-N-(phenylmethyl)piperidine-1-carboxamide Openeye Name: (3S)-N-benzyl-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide CAS Name: (3S)-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]-N-(phenylmethyl)-1-piperidinecarboxamide IUPAC Name: (3S)-N-benzyl-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide Traditional Name: (3S)-N-benzyl-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidine-1-carboxamide Formula: C17H23N5OS MolecularWeight: 345.46242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2CCCN(C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SC)[C@H]2CCCN(C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H23N5OS/c1-21-15(19-20-17(21)24-2)14-9-6-10-22(12-14)16(23)18-11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3,(H,18,23)/t14-/m0/s1