2-methoxy-3-[5-[(4-methylsulfonylpiperazin-1-yl)methyl]-1-oxidanyl-indol-2-yl]quinoline

Systemtic Name: 2-methoxy-3-[5-[(4-methylsulfonylpiperazin-1-yl)methyl]-1-oxidanyl-indol-2-yl]quinoline Openeye Name: 3-[1-hydroxy-5-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-yl]-2-methoxy-quinoline CAS Name: 3-[1-hydroxy-5-[(4-methylsulfonyl-1-piperazinyl)methyl]-2-indolyl]-2-methoxyquinoline IUPAC Name: 3-[1-hydroxy-5-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-yl]-2-methoxyquinoline Traditional Name: 3-[1-hydroxy-5-[(4-mesylpiperazino)methyl]indol-2-yl]-2-methoxy-quinoline Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC=C2C=C1C3=CC4=C(N3O)C=CC(=C4)CN5CCN(CC5)S(=O)(=O)C

Isomeric SMILES

COC1=NC2=CC=CC=C2C=C1C3=CC4=C(N3O)C=CC(=C4)CN5CCN(CC5)S(=O)(=O)C

InChI

InChI=1S/C24H26N4O4S/c1-32-24-20(14-18-5-3-4-6-21(18)25-24)23-15-19-13-17(7-8-22(19)28(23)29)16-26-9-11-27(12-10-26)33(2,30)31/h3-8,13-15,29H,9-12,16H2,1-2H3