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

Systemtic Name: 2-[(5-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5,8-dimethyl-1H-quinolin-4-one Openeye Name: 2-[(5-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5,8-dimethyl-1H-quinolin-4-one CAS Name: 2-[[(5-butyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-5,8-dimethyl-1H-quinolin-4-one IUPAC Name: 2-[(5-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5,8-dimethyl-1H-quinolin-4-one Traditional Name: 2-[[(5-butyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-5,8-dimethyl-4-quinolone Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1C)SCC2=CC(=O)C3=C(C=CC(=C3N2)C)C

Isomeric SMILES

CCCCC1=NN=C(N1C)SCC2=CC(=O)C3=C(C=CC(=C3N2)C)C

InChI

InChI=1S/C19H24N4OS/c1-5-6-7-16-21-22-19(23(16)4)25-11-14-10-15(24)17-12(2)8-9-13(3)18(17)20-14/h8-10H,5-7,11H2,1-4H3,(H,20,24)