[4-(6-chloranylquinolin-2-yl)piperazin-1-yl]-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)methanone

Systemtic Name: [4-(6-chloranylquinolin-2-yl)piperazin-1-yl]-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)methanone Openeye Name: [4-(6-chloro-2-quinolyl)piperazin-1-yl]-[2-(cyclopentoxy)-5-methylsulfonyl-phenyl]methanone CAS Name: [4-(6-chloro-2-quinolinyl)-1-piperazinyl]-(2-cyclopentyloxy-5-methylsulfonylphenyl)methanone IUPAC Name: [4-(6-chloroquinolin-2-yl)piperazin-1-yl]-(2-cyclopentyloxy-5-methylsulfonylphenyl)methanone Traditional Name: [4-(6-chloro-2-quinolyl)piperazino]-[2-(cyclopentoxy)-5-mesyl-phenyl]methanone Formula: C26H28ClN3O4S MolecularWeight: 514.03622

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=NC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=NC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C26H28ClN3O4S/c1-35(32,33)21-8-10-24(34-20-4-2-3-5-20)22(17-21)26(31)30-14-12-29(13-15-30)25-11-6-18-16-19(27)7-9-23(18)28-25/h6-11,16-17,20H,2-5,12-15H2,1H3