3-(4-fluorophenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-(4-morpholinosulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[[4-(4-morpholinylsulfonyl)-2-nitrophenyl]thio]-4-quinazolinone IUPAC Name: 3-(4-fluorophenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)sulfanylquinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[(4-morpholinosulfonyl-2-nitro-phenyl)thio]quinazolin-4-one Formula: C24H19FN4O6S2 MolecularWeight: 542.559263

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F)[N+](=O)[O-]

InChI

InChI=1S/C24H19FN4O6S2/c25-16-5-7-17(8-6-16)28-23(30)19-3-1-2-4-20(19)26-24(28)36-22-10-9-18(15-21(22)29(31)32)37(33,34)27-11-13-35-14-12-27/h1-10,15H,11-14H2