6-fluoranyl-3-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-fluoranyl-3-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-fluoro-3-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-fluoro-3-[2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-fluoro-3-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-fluoro-3-[2-keto-2-[4-(3-nitrophenyl)sulfonylpiperazino]ethyl]quinazolin-4-one Formula: C20H18FN5O6S MolecularWeight: 475.450223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O6S/c21-14-4-5-18-17(10-14)20(28)24(13-22-18)12-19(27)23-6-8-25(9-7-23)33(31,32)16-3-1-2-15(11-16)26(29)30/h1-5,10-11,13H,6-9,12H2