4-bromanyl-N-ethyl-N-[2-(4-phenylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-ethyl-N-[2-(4-phenylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]benzenesulfonamide Openeye Name: 4-bromo-N-ethyl-N-[2-(4-phenylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide CAS Name: 4-bromo-N-ethyl-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-benzothiophen-5-yl]benzenesulfonamide IUPAC Name: 4-bromo-N-ethyl-N-[2-(4-phenylpiperazine-1-carbonyl)-1-benzothiophen-5-yl]benzenesulfonamide Traditional Name: 4-bromo-N-ethyl-N-[2-(4-phenylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide Formula: C27H26BrN3O3S2 MolecularWeight: 584.54764

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H26BrN3O3S2/c1-2-31(36(33,34)24-11-8-21(28)9-12-24)23-10-13-25-20(18-23)19-26(35-25)27(32)30-16-14-29(15-17-30)22-6-4-3-5-7-22/h3-13,18-19H,2,14-17H2,1H3