[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(7-fluoranyl-2-methyl-quinolin-3-yl)methanone

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(7-fluoranyl-2-methyl-quinolin-3-yl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(7-fluoro-2-methyl-3-quinolyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-(7-fluoro-2-methyl-3-quinolinyl)methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(7-fluoro-2-methylquinolin-3-yl)methanone Traditional Name: (7-fluoro-2-methyl-3-quinolyl)-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C21H18FN5O3S2 MolecularWeight: 471.527723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H18FN5O3S2/c1-13-16(11-14-5-6-15(22)12-18(14)23-13)21(28)26-7-9-27(10-8-26)32(29,30)19-4-2-3-17-20(19)25-31-24-17/h2-6,11-12H,7-10H2,1H3