1-[4-bromanyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride

Systemtic Name: 1-[4-bromanyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride Openeye Name: 1-[4-bromo-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride CAS Name: 1-[4-bromo-3-[(4-ethyl-1-piperazinyl)methyl]phenyl]sulfonylindole dihydrochloride IUPAC Name: 1-[4-bromo-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride Traditional Name: 1-[4-bromo-3-[(4-ethylpiperazino)methyl]phenyl]sulfonylindole dihydrochloride Formula: C21H26BrCl2N3O2S MolecularWeight: 535.32504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=CC=CC=C43)Br.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=CC=CC=C43)Br.Cl.Cl

InChI

InChI=1S/C21H24BrN3O2S.2ClH/c1-2-23-11-13-24(14-12-23)16-18-15-19(7-8-20(18)22)28(26,27)25-10-9-17-5-3-4-6-21(17)25;;/h3-10,15H,2,11-14,16H2,1H3;2*1H