1-(3,5-dimethylpiperidin-1-yl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanone

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanone Openeye Name: 1-(3,5-dimethyl-1-piperidyl)-2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone CAS Name: 1-(3,5-dimethyl-1-piperidinyl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanone IUPAC Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanone Traditional Name: 1-(3,5-dimethylpiperidino)-2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H24N4O2S/c1-12-8-13(2)10-21(9-12)16(23)11-22-17(19-20-18(22)25)14-4-6-15(24-3)7-5-14/h4-7,12-13H,8-11H2,1-3H3,(H,20,25)