N-[6,8-bis(fluoranyl)-2-methyl-quinolin-4-yl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[6,8-bis(fluoranyl)-2-methyl-quinolin-4-yl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6,8-difluoro-2-methyl-4-quinolyl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(6,8-difluoro-2-methyl-4-quinolinyl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6,8-difluoro-2-methylquinolin-4-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(6,8-difluoro-2-methyl-4-quinolyl)benzamide Formula: C23H22F2N4O4S MolecularWeight: 488.506986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C)F)F

Isomeric SMILES

CC1=NC2=C(C=C(C=C2C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C)F)F

InChI

InChI=1S/C23H22F2N4O4S/c1-14-10-21(19-12-17(24)13-20(25)22(19)26-14)27-23(31)16-4-3-5-18(11-16)34(32,33)29-8-6-28(7-9-29)15(2)30/h3-5,10-13H,6-9H2,1-2H3,(H,26,27,31)