6-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxidanylidene-1H-quinolin-3-yl)indole-1-carboxylate

Systemtic Name: 6-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxidanylidene-1H-quinolin-3-yl)indole-1-carboxylate Openeye Name: 6-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxo-1H-quinolin-3-yl)indole-1-carboxylate CAS Name: 6-[(4-methylsulfonyl-1-piperazinyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)-1-indolecarboxylate IUPAC Name: 6-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-(2-oxo-1H-quinolin-3-yl)indole-1-carboxylate Traditional Name: 2-(2-keto-1H-quinolin-3-yl)-6-[(4-mesylpiperazino)methyl]indole-1-carboxylate Formula: C24H23N4O5S- MolecularWeight: 479.52822

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(C=C2)C=C(N3C(=O)[O-])C4=CC5=CC=CC=C5NC4=O

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC3=C(C=C2)C=C(N3C(=O)[O-])C4=CC5=CC=CC=C5NC4=O

InChI

InChI=1S/C24H24N4O5S/c1-34(32,33)27-10-8-26(9-11-27)15-16-6-7-18-14-22(28(24(30)31)21(18)12-16)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)/p-1