N-(2,3-dimethylphenyl)-2-[4-ethyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-ethyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-ethyl-5-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[4-ethyl-5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-ethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[4-ethyl-5-[(2-keto-2-piperidino-ethyl)thio]-1,2,4-triazol-3-yl]acetamide Formula: C21H29N5O2S MolecularWeight: 415.55226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCCCC2)CC(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCCCC2)CC(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C21H29N5O2S/c1-4-26-18(13-19(27)22-17-10-8-9-15(2)16(17)3)23-24-21(26)29-14-20(28)25-11-6-5-7-12-25/h8-10H,4-7,11-14H2,1-3H3,(H,22,27)