1-[4-ethoxy-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]phenyl]ethanone Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NN=CN2C3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NN=CN2C3=CC=CC=C3C

InChI

InChI=1S/C20H21N3O2S/c1-4-25-19-10-9-16(15(3)24)11-17(19)12-26-20-22-21-13-23(20)18-8-6-5-7-14(18)2/h5-11,13H,4,12H2,1-3H3