4-bromanyl-N-methyl-N-[2-(4-methylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-methyl-N-[2-(4-methylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]benzenesulfonamide Openeye Name: 4-bromo-N-methyl-N-[2-(4-methylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide CAS Name: 4-bromo-N-methyl-N-[2-[(4-methyl-1-piperazinyl)-oxomethyl]-1-benzothiophen-5-yl]benzenesulfonamide IUPAC Name: 4-bromo-N-methyl-N-[2-(4-methylpiperazine-1-carbonyl)-1-benzothiophen-5-yl]benzenesulfonamide Traditional Name: 4-bromo-N-methyl-N-[2-(4-methylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide Formula: C21H22BrN3O3S2 MolecularWeight: 508.45168

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)N(C)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)N(C)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H22BrN3O3S2/c1-23-9-11-25(12-10-23)21(26)20-14-15-13-17(5-8-19(15)29-20)24(2)30(27,28)18-6-3-16(22)4-7-18/h3-8,13-14H,9-12H2,1-2H3