methyl 3-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-[methyl(p-tolylsulfonyl)amino]benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-[methyl(tosyl)amino]benzoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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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)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O5S2/c1-14-4-10-17(11-5-14)30(26,27)23(2)16-8-6-15(7-9-16)20(24)22-18-12-13-29-19(18)21(25)28-3/h4-13H,1-3H3,(H,22,24)