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

Systemtic Name: N-cyclopropyl-5-[ethyl-(4-methylphenyl)sulfonyl-amino]-1-benzothiophene-2-carboxamide Openeye Name: N-cyclopropyl-5-[ethyl(p-tolylsulfonyl)amino]benzothiophene-2-carboxamide CAS Name: N-cyclopropyl-5-[ethyl-(4-methylphenyl)sulfonylamino]-1-benzothiophene-2-carboxamide IUPAC Name: N-cyclopropyl-5-[ethyl-(4-methylphenyl)sulfonylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-cyclopropyl-5-[ethyl(tosyl)amino]benzothiophene-2-carboxamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H22N2O3S2/c1-3-23(28(25,26)18-9-4-14(2)5-10-18)17-8-11-19-15(12-17)13-20(27-19)21(24)22-16-6-7-16/h4-5,8-13,16H,3,6-7H2,1-2H3,(H,22,24)