[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(6-methoxy-2-methyl-quinolin-3-yl)methanone

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(6-methoxy-2-methyl-quinolin-3-yl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(6-methoxy-2-methyl-3-quinolyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-(6-methoxy-2-methyl-3-quinolinyl)methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(6-methoxy-2-methylquinolin-3-yl)methanone Traditional Name: (6-methoxy-2-methyl-3-quinolyl)-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C22H21N5O4S2 MolecularWeight: 483.56324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O4S2/c1-14-17(13-15-12-16(31-2)6-7-18(15)23-14)22(28)26-8-10-27(11-9-26)33(29,30)20-5-3-4-19-21(20)25-32-24-19/h3-7,12-13H,8-11H2,1-2H3