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

Systemtic Name: 1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-4-piperidino-isonipecotamide Formula: C23H32N6O2S MolecularWeight: 456.60418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCC(CC2)(C(=O)N)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCC(CC2)(C(=O)N)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H32N6O2S/c1-2-29-20(18-9-5-3-6-10-18)25-26-22(29)32-17-19(30)27-15-11-23(12-16-27,21(24)31)28-13-7-4-8-14-28/h3,5-6,9-10H,2,4,7-8,11-17H2,1H3,(H2,24,31)