2-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[4-[methyl(tosyl)amino]phenoxy]acetyl]amino]thiophene-3-carboxamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C21H21N3O5S2/c1-14-3-9-17(10-4-14)31(27,28)24(2)15-5-7-16(8-6-15)29-13-19(25)23-21-18(20(22)26)11-12-30-21/h3-12H,13H2,1-2H3,(H2,22,26)(H,23,25)