5-chloranyl-3-methyl-N-[4-methyl-3-(4-methylpiperazin-1-yl)phenyl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-[4-methyl-3-(4-methylpiperazin-1-yl)phenyl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-3-methyl-N-[4-methyl-3-(4-methylpiperazin-1-yl)phenyl]benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[4-methyl-3-(4-methyl-1-piperazinyl)phenyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-N-[4-methyl-3-(4-methylpiperazin-1-yl)phenyl]-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-3-methyl-N-[4-methyl-3-(4-methylpiperazino)phenyl]benzothiophene-2-sulfonamide Formula: C21H24ClN3O2S2 MolecularWeight: 450.01716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C)N4CCN(CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C)N4CCN(CC4)C

InChI

InChI=1S/C21H24ClN3O2S2/c1-14-4-6-17(13-19(14)25-10-8-24(3)9-11-25)23-29(26,27)21-15(2)18-12-16(22)5-7-20(18)28-21/h4-7,12-13,23H,8-11H2,1-3H3