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

Systemtic Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidin-1-yl)ethanone Openeye Name: 2-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(4-phenyl-1-piperidyl)ethanone CAS Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenyl-1-piperidinyl)ethanone IUPAC Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidin-1-yl)ethanone Traditional Name: 1-(4-phenylpiperidino)-2-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethanone Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-2-29-20-10-8-19(9-11-20)22-24-25-23(30)27(22)16-21(28)26-14-12-18(13-15-26)17-6-4-3-5-7-17/h3-11,18H,2,12-16H2,1H3,(H,25,30)