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

Systemtic Name: 6,8-dimethyl-4-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 6,8-dimethyl-4-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one CAS Name: 6,8-dimethyl-4-[[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-2-one IUPAC Name: 6,8-dimethyl-4-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 6,8-dimethyl-4-[[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]methyl]carbostyril Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=O)N2)CSC3=NN=C(N3C)COC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=O)N2)CSC3=NN=C(N3C)COC4=CC=CC=C4)C

InChI

InChI=1S/C22H22N4O2S/c1-14-9-15(2)21-18(10-14)16(11-20(27)23-21)13-29-22-25-24-19(26(22)3)12-28-17-7-5-4-6-8-17/h4-11H,12-13H2,1-3H3,(H,23,27)