methyl 6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]pyridazine-3-carboxylate

Systemtic Name: methyl 6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]pyridazine-3-carboxylate Openeye Name: methyl 6-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]pyridazine-3-carboxylate CAS Name: 6-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]pyridazine-3-carboxylate Traditional Name: 6-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]pyridazine-3-carboxylic acid methyl ester Formula: C20H21N5O4S MolecularWeight: 427.47684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=NN=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=NN=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H21N5O4S/c1-14-12-15-4-3-5-17(19(15)21-13-14)30(27,28)25-10-8-24(9-11-25)18-7-6-16(22-23-18)20(26)29-2/h3-7,12-13H,8-11H2,1-2H3