(2-cyclopentyloxy-5-methylsulfonyl-phenyl)-(4-quinolin-3-ylpiperazin-1-yl)methanone

Systemtic Name: (2-cyclopentyloxy-5-methylsulfonyl-phenyl)-(4-quinolin-3-ylpiperazin-1-yl)methanone Openeye Name: [2-(cyclopentoxy)-5-methylsulfonyl-phenyl]-[4-(3-quinolyl)piperazin-1-yl]methanone CAS Name: (2-cyclopentyloxy-5-methylsulfonylphenyl)-[4-(3-quinolinyl)-1-piperazinyl]methanone IUPAC Name: (2-cyclopentyloxy-5-methylsulfonylphenyl)-(4-quinolin-3-ylpiperazin-1-yl)methanone Traditional Name: [2-(cyclopentoxy)-5-mesyl-phenyl]-[4-(3-quinolyl)piperazino]methanone Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H29N3O4S/c1-34(31,32)22-10-11-25(33-21-7-3-4-8-21)23(17-22)26(30)29-14-12-28(13-15-29)20-16-19-6-2-5-9-24(19)27-18-20/h2,5-6,9-11,16-18,21H,3-4,7-8,12-15H2,1H3