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

Systemtic Name: 5,7-dimethyl-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 5,7-dimethyl-2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 5,7-dimethyl-2-[[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 5,7-dimethyl-2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 5,7-dimethyl-2-[[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=NN2)SCC3=CC(=O)C4=C(C=C(C=C4N3)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=NN2)SCC3=CC(=O)C4=C(C=C(C=C4N3)C)C

InChI

InChI=1S/C21H20N4OS/c1-12-5-4-6-15(8-12)20-23-21(25-24-20)27-11-16-10-18(26)19-14(3)7-13(2)9-17(19)22-16/h4-10H,11H2,1-3H3,(H,22,26)(H,23,24,25)