N-(3-ethanoylphenyl)-4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine-1-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]piperidine-1-carboxamide Openeye Name: N-(3-acetylphenyl)-4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide CAS Name: N-(3-acetylphenyl)-4-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-1-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide Traditional Name: N-(3-acetylphenyl)-4-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]piperidine-1-carboxamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)C3=NN=C(N3C)SCC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)C3=NN=C(N3C)SCC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O2S/c1-17(30)20-9-6-10-21(15-20)25-23(31)29-13-11-19(12-14-29)22-26-27-24(28(22)2)32-16-18-7-4-3-5-8-18/h3-10,15,19H,11-14,16H2,1-2H3,(H,25,31)