N-(2-aminophenyl)-6-[[(4-methoxyphenyl)methyl-methylsulfonyl-amino]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[[(4-methoxyphenyl)methyl-methylsulfonyl-amino]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[[(4-methoxyphenyl)methyl-methylsulfonyl-amino]methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[[(4-methoxyphenyl)methyl-methylsulfonylamino]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[[(4-methoxyphenyl)methyl-methylsulfonylamino]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[[mesyl(p-anisyl)amino]methyl]benzothiophene-2-carboxamide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)S(=O)(=O)C

InChI

InChI=1S/C25H25N3O4S2/c1-32-20-11-8-17(9-12-20)15-28(34(2,30)31)16-18-7-10-19-14-24(33-23(19)13-18)25(29)27-22-6-4-3-5-21(22)26/h3-14H,15-16,26H2,1-2H3,(H,27,29)