1-(4-methoxyphenyl)-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N3O2S/c1-12-4-3-5-14(10-12)17-19-18(21-20-17)24-11-16(22)13-6-8-15(23-2)9-7-13/h3-10H,11H2,1-2H3,(H,19,20,21)