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

Systemtic Name: N-ethyl-4-methyl-N-[2-(4-methylpiperazin-1-yl)carbonyl-1-benzothiophen-5-yl]benzenesulfonamide Openeye Name: N-ethyl-4-methyl-N-[2-(4-methylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide CAS Name: N-ethyl-4-methyl-N-[2-[(4-methyl-1-piperazinyl)-oxomethyl]-1-benzothiophen-5-yl]benzenesulfonamide IUPAC Name: N-ethyl-4-methyl-N-[2-(4-methylpiperazine-1-carbonyl)-1-benzothiophen-5-yl]benzenesulfonamide Traditional Name: N-ethyl-4-methyl-N-[2-(4-methylpiperazine-1-carbonyl)benzothiophen-5-yl]benzenesulfonamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S2/c1-4-26(31(28,29)20-8-5-17(2)6-9-20)19-7-10-21-18(15-19)16-22(30-21)23(27)25-13-11-24(3)12-14-25/h5-10,15-16H,4,11-14H2,1-3H3