7,8-dimethyl-2-[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one

Systemtic Name: 7,8-dimethyl-2-[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 7,8-dimethyl-2-[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 7,8-dimethyl-2-[[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 7,8-dimethyl-2-[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 7,8-dimethyl-2-[[[4-methyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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