1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]acetyl]-N-phenyl-nipecotamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NN=C(N2C3CC3)C4CC4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NN=C(N2C3CC3)C4CC4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C22H27N5O2S/c28-19(14-30-22-25-24-20(15-8-9-15)27(22)18-10-11-18)26-12-4-5-16(13-26)21(29)23-17-6-2-1-3-7-17/h1-3,6-7,15-16,18H,4-5,8-14H2,(H,23,29)