1-(4-phenylmethoxypiperidin-1-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-phenylmethoxypiperidin-1-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-benzyloxy-1-piperidyl)-2-[[4-(4-isopropylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-phenylmethoxy-1-piperidinyl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-phenylmethoxypiperidin-1-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-benzoxypiperidino)-2-[(4-p-cumenyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)N3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)N3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-19(2)21-8-10-22(11-9-21)29-18-26-27-25(29)32-17-24(30)28-14-12-23(13-15-28)31-16-20-6-4-3-5-7-20/h3-11,18-19,23H,12-17H2,1-2H3