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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2CCC(CC2)C(=O)N)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2CCC(CC2)C(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N5O2S/c1-22-15(11-13-5-3-2-4-6-13)20-21-18(22)26-12-16(24)23-9-7-14(8-10-23)17(19)25/h2-6,14H,7-12H2,1H3,(H2,19,25)