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

Systemtic Name: 1-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]isonipecotamide Formula: C17H21N5O2S MolecularWeight: 359.44594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H21N5O2S/c1-12-4-2-3-5-14(12)22-11-19-20-17(22)25-10-15(23)21-8-6-13(7-9-21)16(18)24/h2-5,11,13H,6-10H2,1H3,(H2,18,24)