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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-methyl-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-methyl-benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-methyl-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-methyl-benzothiophene-2-carboxamide Formula: C18H17BrN2O3S2 MolecularWeight: 453.37318

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O3S2/c1-3-21(26(23,24)15-7-4-13(19)5-8-15)14-6-9-16-12(10-14)11-17(25-16)18(22)20-2/h4-11H,3H2,1-2H3,(H,20,22)