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

Systemtic Name: 5-chloranyl-3-methyl-N-[3-(4-methylpiperazin-1-yl)-4-oxidanyl-phenyl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-N-[4-hydroxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-benzothiophene-2-sulfonamide CAS Name: 5-chloro-N-[4-hydroxy-3-(4-methyl-1-piperazinyl)phenyl]-3-methyl-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-N-[4-hydroxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[4-hydroxy-3-(4-methylpiperazino)phenyl]-3-methyl-benzothiophene-2-sulfonamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC(=C(C=C3)O)N4CCN(CC4)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC(=C(C=C3)O)N4CCN(CC4)C

InChI

InChI=1S/C20H22ClN3O3S2/c1-13-16-11-14(21)3-6-19(16)28-20(13)29(26,27)22-15-4-5-18(25)17(12-15)24-9-7-23(2)8-10-24/h3-6,11-12,22,25H,7-10H2,1-2H3