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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-cyclopropyl-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-cyclopropyl-benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-cyclopropyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-cyclopropyl-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(methyl)amino]-N-cyclopropyl-benzothiophene-2-carboxamide Formula: C19H17BrN2O3S2 MolecularWeight: 465.38388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H17BrN2O3S2/c1-22(27(24,25)16-7-2-13(20)3-8-16)15-6-9-17-12(10-15)11-18(26-17)19(23)21-14-4-5-14/h2-3,6-11,14H,4-5H2,1H3,(H,21,23)