[3-(methylsulfonylmethyl)phenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-(methylsulfonylmethyl)phenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-(methylsulfonylmethyl)phenyl]-[4-(8-quinolylmethyl)piperazin-1-yl]methanone CAS Name: [3-(methylsulfonylmethyl)phenyl]-[4-(8-quinolinylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-(methylsulfonylmethyl)phenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-(mesylmethyl)phenyl]-[4-(8-quinolylmethyl)piperazino]methanone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H25N3O3S/c1-30(28,29)17-18-5-2-7-20(15-18)23(27)26-13-11-25(12-14-26)16-21-8-3-6-19-9-4-10-24-22(19)21/h2-10,15H,11-14,16-17H2,1H3