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

Systemtic Name: 2-[[5-[(3,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-8-methyl-1H-quinolin-4-one Openeye Name: 2-[[5-[(3,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-8-methyl-1H-quinolin-4-one CAS Name: 2-[[[5-[(3,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-8-methyl-1H-quinolin-4-one IUPAC Name: 2-[[5-[(3,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-8-methyl-1H-quinolin-4-one Traditional Name: 2-[[[5-[(3,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-8-methyl-4-quinolone Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=NN=C(N2C)SCC3=CC(=O)C4=C(N3)C(=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=NN=C(N2C)SCC3=CC(=O)C4=C(N3)C(=CC=C4)C)C

InChI

InChI=1S/C23H24N4O2S/c1-14-8-9-18(10-16(14)3)29-12-21-25-26-23(27(21)4)30-13-17-11-20(28)19-7-5-6-15(2)22(19)24-17/h5-11H,12-13H2,1-4H3,(H,24,28)