4-chloranyl-1-[4-chloranyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride

Systemtic Name: 4-chloranyl-1-[4-chloranyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride Openeye Name: 4-chloro-1-[4-chloro-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride CAS Name: 4-chloro-1-[4-chloro-3-[(4-ethyl-1-piperazinyl)methyl]phenyl]sulfonylindole dihydrochloride IUPAC Name: 4-chloro-1-[4-chloro-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride Traditional Name: 4-chloro-1-[4-chloro-3-[(4-ethylpiperazino)methyl]phenyl]sulfonyl-indole dihydrochloride Formula: C21H25Cl4N3O2S MolecularWeight: 525.3191

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=C3C=CC=C4Cl)Cl.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=C3C=CC=C4Cl)Cl.Cl.Cl

InChI

InChI=1S/C21H23Cl2N3O2S.2ClH/c1-2-24-10-12-25(13-11-24)15-16-14-17(6-7-19(16)22)29(27,28)26-9-8-18-20(23)4-3-5-21(18)26;;/h3-9,14H,2,10-13,15H2,1H3;2*1H