4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]-N-(phenylmethyl)piperidine-1-carboxamide

Systemtic Name: 4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]-N-(phenylmethyl)piperidine-1-carboxamide Openeye Name: N-benzyl-4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide CAS Name: 4-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-N-(phenylmethyl)-1-piperidinecarboxamide IUPAC Name: N-benzyl-4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide Traditional Name: N-benzyl-4-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]piperidine-1-carboxamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3CCN(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3CCN(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H27N5OS/c1-27-21(25-26-23(27)30-17-19-10-6-3-7-11-19)20-12-14-28(15-13-20)22(29)24-16-18-8-4-2-5-9-18/h2-11,20H,12-17H2,1H3,(H,24,29)