3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-chloro-2-methoxy-5-methylphenyl)-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]-4-quinazolinone IUPAC Name: 3-(4-chloro-2-methoxy-5-methylphenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanylquinazolin-4-one Traditional Name: 3-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]quinazolin-4-one Formula: C23H15ClF3N3O4S MolecularWeight: 521.89611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)N2C(=O)C3=CC=CC=C3N=C2SC4=CC(=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)N2C(=O)C3=CC=CC=C3N=C2SC4=CC(=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C23H15ClF3N3O4S/c1-12-9-19(20(34-2)11-16(12)24)29-21(31)14-5-3-4-6-17(14)28-22(29)35-13-7-8-18(30(32)33)15(10-13)23(25,26)27/h3-11H,1-2H3