1-(2-bromanyl-4-methoxy-phenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]-5-phenylmethoxy-indole

Systemtic Name: 1-(2-bromanyl-4-methoxy-phenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]-5-phenylmethoxy-indole Openeye Name: 5-benzyloxy-1-(2-bromo-4-methoxy-phenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole CAS Name: 1-(2-bromo-4-methoxyphenyl)sulfonyl-2-[(4-methyl-1-piperazinyl)methyl]-5-phenylmethoxyindole IUPAC Name: 1-(2-bromo-4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]-5-phenylmethoxyindole Traditional Name: 5-benzoxy-1-(2-bromo-4-methoxy-phenyl)sulfonyl-2-[(4-methylpiperazino)methyl]indole Formula: C28H30BrN3O4S MolecularWeight: 584.5245

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC3=C(N2S(=O)(=O)C4=C(C=C(C=C4)OC)Br)C=CC(=C3)OCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CC2=CC3=C(N2S(=O)(=O)C4=C(C=C(C=C4)OC)Br)C=CC(=C3)OCC5=CC=CC=C5

InChI

InChI=1S/C28H30BrN3O4S/c1-30-12-14-31(15-13-30)19-23-16-22-17-25(36-20-21-6-4-3-5-7-21)8-10-27(22)32(23)37(33,34)28-11-9-24(35-2)18-26(28)29/h3-11,16-18H,12-15,19-20H2,1-2H3