2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(6-fluoro-4-oxo-quinazolin-3-yl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-(6-fluoro-4-oxo-3-quinazolinyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(6-fluoro-4-oxoquinazolin-3-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-(6-fluoro-4-keto-quinazolin-3-yl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C19H18FN5O6S MolecularWeight: 463.439523

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H18FN5O6S/c1-32(30,31)13-3-5-16(17(9-13)25(28)29)21-6-7-22-18(26)10-24-11-23-15-4-2-12(20)8-14(15)19(24)27/h2-5,8-9,11,21H,6-7,10H2,1H3,(H,22,26)