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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-5-[(4-bromophenyl)sulfonyl-methyl-amino]benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-5-[(4-bromophenyl)sulfonyl-methylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-5-[brosyl(methyl)amino]benzothiophene-2-carboxamide Formula: C23H19BrN2O3S2 MolecularWeight: 515.44256

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H19BrN2O3S2/c1-26(31(28,29)20-10-7-18(24)8-11-20)19-9-12-21-17(13-19)14-22(30-21)23(27)25-15-16-5-3-2-4-6-16/h2-14H,15H2,1H3,(H,25,27)