7-chloranyl-3-(2-methylphenyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methylphenyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-2-[(3-nitrophenyl)methylsulfanyl]-3-(o-tolyl)quinazolin-4-one CAS Name: 7-chloro-3-(2-methylphenyl)-2-[(3-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylphenyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-2-[(3-nitrobenzyl)thio]-3-(o-tolyl)quinazolin-4-one Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16ClN3O3S/c1-14-5-2-3-8-20(14)25-21(27)18-10-9-16(23)12-19(18)24-22(25)30-13-15-6-4-7-17(11-15)26(28)29/h2-12H,13H2,1H3