4-[4-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[2-(6-fluoro-4-oxo-quinazolin-3-yl)acetyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[2-(6-fluoro-4-oxo-3-quinazolinyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[2-(6-fluoro-4-oxoquinazolin-3-yl)acetyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[2-(6-fluoro-4-keto-quinazolin-3-yl)acetyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C20H21FN6O5S MolecularWeight: 476.481343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C20H21FN6O5S/c1-24-10-14(9-17(24)19(22)29)33(31,32)27-6-4-25(5-7-27)18(28)11-26-12-23-16-3-2-13(21)8-15(16)20(26)30/h2-3,8-10,12H,4-7,11H2,1H3,(H2,22,29)