N-(2-ethylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-ethylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-ethylphenyl)-5-[methylsulfonyl(p-tolylmethyl)amino]benzothiophene-2-carboxamide CAS Name: N-(2-ethylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonylamino]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-ethylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-ethylphenyl)-5-[mesyl-(4-methylbenzyl)amino]benzothiophene-2-carboxamide Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CC=C(C=C4)C)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CC=C(C=C4)C)S(=O)(=O)C

InChI

InChI=1S/C26H26N2O3S2/c1-4-20-7-5-6-8-23(20)27-26(29)25-16-21-15-22(13-14-24(21)32-25)28(33(3,30)31)17-19-11-9-18(2)10-12-19/h5-16H,4,17H2,1-3H3,(H,27,29)