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

Systemtic Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-3-phenyl-quinazolin-4-one CAS Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-3-phenyl-4-quinazolinone IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-3-phenylquinazolin-4-one Traditional Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-3-phenyl-quinazolin-4-one Formula: C21H12F3N3O3S MolecularWeight: 443.39849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H12F3N3O3S/c22-21(23,24)13-10-11-18(17(12-13)27(29)30)31-20-25-16-9-5-4-8-15(16)19(28)26(20)14-6-2-1-3-7-14/h1-12H