1-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[4-methoxy-3-(4-methylpiperazino)phenyl]sulfonyl-7-phenyl-1,2,3,4-tetrahydroisoquinoline Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)C3C4=C(CCN3)C=CC(=C4)C5=CC=CC=C5)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)C3C4=C(CCN3)C=CC(=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H31N3O3S/c1-29-14-16-30(17-15-29)25-19-23(10-11-26(25)33-2)34(31,32)27-24-18-22(20-6-4-3-5-7-20)9-8-21(24)12-13-28-27/h3-11,18-19,27-28H,12-17H2,1-2H3