5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-8-ethoxy-quinoline

Systemtic Name: 5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-8-ethoxy-quinoline Openeye Name: 5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-8-ethoxy-quinoline CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]sulfonyl]-8-ethoxyquinoline IUPAC Name: 5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]sulfonyl-8-ethoxyquinoline Traditional Name: 5-[4-(4-chlorophenyl)sulfonylpiperazino]sulfonyl-8-ethoxy-quinoline Formula: C21H22ClN3O5S2 MolecularWeight: 495.99948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C=CC=N2

InChI

InChI=1S/C21H22ClN3O5S2/c1-2-30-19-9-10-20(18-4-3-11-23-21(18)19)32(28,29)25-14-12-24(13-15-25)31(26,27)17-7-5-16(22)6-8-17/h3-11H,2,12-15H2,1H3