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

Systemtic Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-methoxy-2,5-dimethylphenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(4-methoxy-2,5-dimethylphenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)C)OC

InChI

InChI=1S/C24H22N4O2S/c1-16-14-22(30-3)17(2)13-20(16)21(29)15-31-24-27-26-23(18-9-11-25-12-10-18)28(24)19-7-5-4-6-8-19/h4-14H,15H2,1-3H3