1-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetyl]isonipecotamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)N2CCC(CC2)C(=O)N)C3=CC(=CC=C3)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)N2CCC(CC2)C(=O)N)C3=CC(=CC=C3)C

InChI

InChI=1S/C20H27N5O2S/c1-3-9-25-19(16-6-4-5-14(2)12-16)22-23-20(25)28-13-17(26)24-10-7-15(8-11-24)18(21)27/h4-6,12,15H,3,7-11,13H2,1-2H3,(H2,21,27)