[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylquinolin-4-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylquinolin-4-yl)methanone Openeye Name: (2-methyl-4-quinolyl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-(2-methyl-4-quinolinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylquinolin-4-yl)methanone Traditional Name: (2-methyl-4-quinolyl)-(4-tosylpiperazino)methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C22H23N3O3S/c1-16-7-9-18(10-8-16)29(27,28)25-13-11-24(12-14-25)22(26)20-15-17(2)23-21-6-4-3-5-19(20)21/h3-10,15H,11-14H2,1-2H3