1-phenyl-2-[[4-phenyl-5-(3-piperidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-phenyl-2-[[4-phenyl-5-(3-piperidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-phenyl-2-[[4-phenyl-5-[3-(1-piperidylsulfonyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-phenyl-2-[[4-phenyl-5-[3-(1-piperidinylsulfonyl)phenyl]-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-phenyl-2-[[4-phenyl-5-(3-piperidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-phenyl-2-[[4-phenyl-5-(3-piperidinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C27H26N4O3S2 MolecularWeight: 518.65034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S2/c32-25(21-11-4-1-5-12-21)20-35-27-29-28-26(31(27)23-14-6-2-7-15-23)22-13-10-16-24(19-22)36(33,34)30-17-8-3-9-18-30/h1-2,4-7,10-16,19H,3,8-9,17-18,20H2