3-azanyl-6-[2-fluoranyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-6-[2-fluoranyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide Openeye Name: 3-amino-6-[2-fluoro-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-(3-pyridyl)pyrazine-2-carboxamide CAS Name: 3-amino-6-[2-fluoro-4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-(3-pyridinyl)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-[2-fluoro-4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide Traditional Name: 3-amino-6-[2-fluoro-4-(4-methylpiperazino)sulfonyl-phenyl]-N-(3-pyridyl)pyrazinamide Formula: C21H22FN7O3S MolecularWeight: 471.507883

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N)F

InChI

InChI=1S/C21H22FN7O3S/c1-28-7-9-29(10-8-28)33(31,32)15-4-5-16(17(22)11-15)18-13-25-20(23)19(27-18)21(30)26-14-3-2-6-24-12-14/h2-6,11-13H,7-10H2,1H3,(H2,23,25)(H,26,30)