5,8-bis(chloranyl)-2-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 5,8-bis(chloranyl)-2-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 5,8-dichloro-2-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 5,8-dichloro-2-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 5,8-dichloro-2-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 5,8-dichloro-2-[4-methoxy-3-(4-methylpiperazino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C21H25Cl2N3O3S MolecularWeight: 470.4125

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=C(C=CC(=C4C3)Cl)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=C(C=CC(=C4C3)Cl)Cl)OC

InChI

InChI=1S/C21H25Cl2N3O3S/c1-24-9-11-25(12-10-24)20-13-15(3-6-21(20)29-2)30(27,28)26-8-7-16-17(14-26)19(23)5-4-18(16)22/h3-6,13H,7-12,14H2,1-2H3