1-[4-chloranyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-5-methoxy-indole dihydrochloride

Systemtic Name: 1-[4-chloranyl-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-5-methoxy-indole dihydrochloride Openeye Name: 1-[4-chloro-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-5-methoxy-indole dihydrochloride CAS Name: 1-[4-chloro-3-[(4-ethyl-1-piperazinyl)methyl]phenyl]sulfonyl-5-methoxyindole dihydrochloride IUPAC Name: 1-[4-chloro-3-[(4-ethylpiperazin-1-yl)methyl]phenyl]sulfonyl-5-methoxyindole dihydrochloride Traditional Name: 1-[4-chloro-3-[(4-ethylpiperazino)methyl]phenyl]sulfonyl-5-methoxy-indole dihydrochloride Formula: C22H28Cl3N3O3S MolecularWeight: 520.90002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=C3C=CC(=C4)OC)Cl.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=CC(=C2)S(=O)(=O)N3C=CC4=C3C=CC(=C4)OC)Cl.Cl.Cl

InChI

InChI=1S/C22H26ClN3O3S.2ClH/c1-3-24-10-12-25(13-11-24)16-18-15-20(5-6-21(18)23)30(27,28)26-9-8-17-14-19(29-2)4-7-22(17)26;;/h4-9,14-15H,3,10-13,16H2,1-2H3;2*1H