2-[(3R)-3-methyl-4-(4-methylsulfonylphenyl)sulfonyl-piperazin-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[(3R)-3-methyl-4-(4-methylsulfonylphenyl)sulfonyl-piperazin-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[(3R)-3-methyl-4-(4-methylsulfonylphenyl)sulfonyl-piperazin-1-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[(3R)-3-methyl-4-(4-methylsulfonylphenyl)sulfonyl-1-piperazinyl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[(3R)-3-methyl-4-(4-methylsulfonylphenyl)sulfonylpiperazin-1-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[(3R)-4-(4-mesylphenyl)sulfonyl-3-methyl-piperazino]-N-(5-quinolyl)acetamide Formula: C23H26N4O5S2 MolecularWeight: 502.60634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)CC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)CC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C23H26N4O5S2/c1-17-15-26(16-23(28)25-22-7-3-6-21-20(22)5-4-12-24-21)13-14-27(17)34(31,32)19-10-8-18(9-11-19)33(2,29)30/h3-12,17H,13-16H2,1-2H3,(H,25,28)/t17-/m1/s1