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

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(4-methylpiperidino)ethanone Formula: C17H22N4O2S MolecularWeight: 346.44718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H22N4O2S/c1-12-7-9-20(10-8-12)15(22)11-21-16(18-19-17(21)24)13-3-5-14(23-2)6-4-13/h3-6,12H,7-11H2,1-2H3,(H,19,24)