3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(2-methylpropylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(2-methylpropylsulfanyl)quinazolin-4-one Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-isobutylsulfanyl-quinazolin-4-one CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-(2-methylpropylthio)-4-quinazolinone IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(2-methylpropylsulfanyl)quinazolin-4-one Traditional Name: 2-(isobutylthio)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)quinazolin-4-one Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(C)C

InChI

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