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

Systemtic Name: 5-[ethyl-(4-methylphenyl)sulfonyl-amino]-N-methyl-N-(phenylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-5-[ethyl(p-tolylsulfonyl)amino]-N-methyl-benzothiophene-2-carboxamide CAS Name: 5-[ethyl-(4-methylphenyl)sulfonylamino]-N-methyl-N-(phenylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-5-[ethyl-(4-methylphenyl)sulfonylamino]-N-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-5-[ethyl(tosyl)amino]-N-methyl-benzothiophene-2-carboxamide Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N(C)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N(C)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

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