1-[4-methoxy-3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[[4-methyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[[4-methyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]methyl]phenyl]ethanone Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C)SCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C)SCC3=C(C=CC(=C3)C(=O)C)OC

InChI

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