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

Systemtic Name: 1-[3-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-phenyl]sulfonylindole dihydrochloride Openeye Name: 1-[3-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-phenyl]sulfonylindole dihydrochloride CAS Name: 1-[3-[(4-ethyl-1-piperazinyl)methyl]-4-methylphenyl]sulfonylindole dihydrochloride IUPAC Name: 1-[3-[(4-ethylpiperazin-1-yl)methyl]-4-methylphenyl]sulfonylindole dihydrochloride Traditional Name: 1-[3-[(4-ethylpiperazino)methyl]-4-methyl-phenyl]sulfonylindole dihydrochloride Formula: C22H29Cl2N3O2S MolecularWeight: 470.45556

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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)C.Cl.Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S.2ClH/c1-3-23-12-14-24(15-13-23)17-20-16-21(9-8-18(20)2)28(26,27)25-11-10-19-6-4-5-7-22(19)25;;/h4-11,16H,3,12-15,17H2,1-2H3;2*1H