5-[ethyl-(4-methylphenyl)sulfonyl-amino]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[ethyl-(4-methylphenyl)sulfonyl-amino]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[ethyl(p-tolylsulfonyl)amino]-N-(tetrahydrofuran-2-ylmethyl)benzothiophene-2-carboxamide CAS Name: 5-[ethyl-(4-methylphenyl)sulfonylamino]-N-(2-oxolanylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[ethyl-(4-methylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[ethyl(tosyl)amino]-N-(tetrahydrofurfuryl)benzothiophene-2-carboxamide Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCC3CCCO3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCC3CCCO3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H26N2O4S2/c1-3-25(31(27,28)20-9-6-16(2)7-10-20)18-8-11-21-17(13-18)14-22(30-21)23(26)24-15-19-5-4-12-29-19/h6-11,13-14,19H,3-5,12,15H2,1-2H3,(H,24,26)