3-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-2-methyl-phenyl)-2-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-2-methylphenyl)-2-[[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-2-methylphenyl)-2-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-2-methyl-phenyl)-2-[[2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl]thio]quinazolin-4-one Formula: C26H21ClN4O2S MolecularWeight: 488.98854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C26H21ClN4O2S/c1-17-20(27)11-7-13-23(17)31-25(33)19-10-5-6-12-22(19)28-26(31)34-16-24(32)30-15-14-21(29-30)18-8-3-2-4-9-18/h2-13H,14-16H2,1H3