5-fluoranyl-1-[4-methyl-3-[(4-methylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride

Systemtic Name: 5-fluoranyl-1-[4-methyl-3-[(4-methylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride Openeye Name: 5-fluoro-1-[4-methyl-3-[(4-methylpiperazin-1-yl)methyl]phenyl]sulfonyl-indole dihydrochloride CAS Name: 5-fluoro-1-[4-methyl-3-[(4-methyl-1-piperazinyl)methyl]phenyl]sulfonylindole dihydrochloride IUPAC Name: 5-fluoro-1-[4-methyl-3-[(4-methylpiperazin-1-yl)methyl]phenyl]sulfonylindole dihydrochloride Traditional Name: 5-fluoro-1-[4-methyl-3-[(4-methylpiperazino)methyl]phenyl]sulfonyl-indole dihydrochloride Formula: C21H26Cl2FN3O2S MolecularWeight: 474.419443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)F)CN4CCN(CC4)C.Cl.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)F)CN4CCN(CC4)C.Cl.Cl

InChI

InChI=1S/C21H24FN3O2S.2ClH/c1-16-3-5-20(14-18(16)15-24-11-9-23(2)10-12-24)28(26,27)25-8-7-17-13-19(22)4-6-21(17)25;;/h3-8,13-14H,9-12,15H2,1-2H3;2*1H