5-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxidanylidene-1H-quinolin-3-yl)indole-1-carboxylic acid

Systemtic Name: 5-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxidanylidene-1H-quinolin-3-yl)indole-1-carboxylic acid Openeye Name: 5-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxo-1H-quinolin-3-yl)indole-1-carboxylic acid CAS Name: 5-[(4-methylsulfonyl-1-piperazinyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)-1-indolecarboxylic acid IUPAC Name: 5-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxo-1H-quinolin-3-yl)indole-1-carboxylic acid Traditional Name: 2-(2-keto-1H-quinolin-3-yl)-5-[(4-mesylpiperazino)methyl]indole-1-carboxylic acid Formula: C24H24N4O5S MolecularWeight: 480.53616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(C=C2)N(C(=C3)C4=CC5=CC=CC=C5NC4=O)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(C=C2)N(C(=C3)C4=CC5=CC=CC=C5NC4=O)C(=O)O

InChI

InChI=1S/C24H24N4O5S/c1-34(32,33)27-10-8-26(9-11-27)15-16-6-7-21-18(12-16)14-22(28(21)24(30)31)19-13-17-4-2-3-5-20(17)25-23(19)29/h2-7,12-14H,8-11,15H2,1H3,(H,25,29)(H,30,31)