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

Systemtic Name: (3S)-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-N-(phenylmethyl)piperidine-1-carboxamide Openeye Name: (3S)-N-benzyl-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide CAS Name: (3S)-3-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]-N-(phenylmethyl)-1-piperidinecarboxamide IUPAC Name: (3S)-N-benzyl-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide Traditional Name: (3S)-N-benzyl-3-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]piperidine-1-carboxamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C)C2CCCN(C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCSC1=NN=C(N1C)[C@H]2CCCN(C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H25N5OS/c1-3-25-18-21-20-16(22(18)2)15-10-7-11-23(13-15)17(24)19-12-14-8-5-4-6-9-14/h4-6,8-9,15H,3,7,10-13H2,1-2H3,(H,19,24)/t15-/m0/s1