5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-morpholin-4-ylethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-morpholin-4-ylethyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-morpholinoethyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-[2-(4-morpholinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(methyl)amino]-N-(2-morpholinoethyl)benzothiophene-2-carboxamide Formula: C22H24BrN3O4S2 MolecularWeight: 538.47766

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCCN3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCCN3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H24BrN3O4S2/c1-25(32(28,29)19-5-2-17(23)3-6-19)18-4-7-20-16(14-18)15-21(31-20)22(27)24-8-9-26-10-12-30-13-11-26/h2-7,14-15H,8-13H2,1H3,(H,24,27)