6,8-dimethyl-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one

Systemtic Name: 6,8-dimethyl-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 6,8-dimethyl-2-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 6,8-dimethyl-2-[[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 6,8-dimethyl-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 6,8-dimethyl-2-[[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=O)C4=CC(=CC(=C4N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=O)C4=CC(=CC(=C4N3)C)C

InChI

InChI=1S/C22H22N4OS/c1-13-5-7-16(8-6-13)21-24-25-22(26(21)4)28-12-17-11-19(27)18-10-14(2)9-15(3)20(18)23-17/h5-11H,12H2,1-4H3,(H,23,27)