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

Systemtic Name: (2R)-1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperidine-2-carboxamide Openeye Name: (2R)-1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-2-carboxamide CAS Name: (2R)-1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-2-piperidinecarboxamide IUPAC Name: (2R)-1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-2-carboxamide Traditional Name: (2R)-1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]pipecolinamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCCCC2C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCCC[C@@H]2C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H23N5O2S/c1-2-22-17(13-8-4-3-5-9-13)20-21-18(22)26-12-15(24)23-11-7-6-10-14(23)16(19)25/h3-5,8-9,14H,2,6-7,10-12H2,1H3,(H2,19,25)/t14-/m1/s1