(5-methylsulfonyl-2-piperidin-1-yl-phenyl)-(4-quinoxalin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-methylsulfonyl-2-piperidin-1-yl-phenyl)-(4-quinoxalin-2-ylpiperazin-1-yl)methanone Openeye Name: [5-methylsulfonyl-2-(1-piperidyl)phenyl]-(4-quinoxalin-2-ylpiperazin-1-yl)methanone CAS Name: [5-methylsulfonyl-2-(1-piperidinyl)phenyl]-[4-(2-quinoxalinyl)-1-piperazinyl]methanone IUPAC Name: (5-methylsulfonyl-2-piperidin-1-ylphenyl)-(4-quinoxalin-2-ylpiperazin-1-yl)methanone Traditional Name: (5-mesyl-2-piperidino-phenyl)-(4-quinoxalin-2-ylpiperazino)methanone Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C25H29N5O3S/c1-34(32,33)19-9-10-23(28-11-5-2-6-12-28)20(17-19)25(31)30-15-13-29(14-16-30)24-18-26-21-7-3-4-8-22(21)27-24/h3-4,7-10,17-18H,2,5-6,11-16H2,1H3