3-(2-chlorophenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanylquinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]quinazolin-4-one Formula: C21H11ClF3N3O3S MolecularWeight: 477.84355

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H11ClF3N3O3S/c22-15-6-2-4-8-18(15)27-19(29)13-5-1-3-7-16(13)26-20(27)32-12-9-10-17(28(30)31)14(11-12)21(23,24)25/h1-11H