2-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]-8-pyridin-4-yl-quinoline

Systemtic Name: 2-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]-8-pyridin-4-yl-quinoline Openeye Name: 2-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]-8-(4-pyridyl)quinoline CAS Name: 2-[4-[(2-methylsulfonylphenyl)methyl]-1-piperazinyl]-8-pyridin-4-ylquinoline IUPAC Name: 2-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]-8-pyridin-4-ylquinoline Traditional Name: 2-[4-(2-mesylbenzyl)piperazino]-8-(4-pyridyl)quinoline Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=NC=C5)C=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=NC=C5)C=C3

InChI

InChI=1S/C26H26N4O2S/c1-33(31,32)24-8-3-2-5-22(24)19-29-15-17-30(18-16-29)25-10-9-21-6-4-7-23(26(21)28-25)20-11-13-27-14-12-20/h2-14H,15-19H2,1H3