5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3,5-dimethylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3,5-dimethylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3,5-dimethylphenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-(3,5-dimethylphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-(3,5-dimethylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(methyl)amino]-N-(3,5-dimethylphenyl)benzothiophene-2-carboxamide Formula: C24H21BrN2O3S2 MolecularWeight: 529.46914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)N(C)S(=O)(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)N(C)S(=O)(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C24H21BrN2O3S2/c1-15-10-16(2)12-19(11-15)26-24(28)23-14-17-13-20(6-9-22(17)31-23)27(3)32(29,30)21-7-4-18(25)5-8-21/h4-14H,1-3H3,(H,26,28)