1-[3-methoxy-4-[2-oxidanyl-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propoxy]phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-[2-oxidanyl-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propoxy]phenyl]ethanone Openeye Name: 1-[4-[2-hydroxy-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[2-hydroxy-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[2-hydroxy-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[2-hydroxy-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propoxy]-3-methoxy-phenyl]ethanone Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)O)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)O)OC

InChI

InChI=1S/C25H24N4O4S/c1-17(30)19-8-9-22(23(14-19)32-2)33-15-21(31)16-34-25-28-27-24(18-10-12-26-13-11-18)29(25)20-6-4-3-5-7-20/h3-14,21,31H,15-16H2,1-2H3