ethyl 3-[(4-methylsulfonylphenyl)carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[(4-methylsulfonylphenyl)carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[(4-methylsulfonylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-methylsulfonylbenzoyl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(4-mesylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H19NO5S2 MolecularWeight: 429.50926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H19NO5S2/c1-3-27-21(24)19-17(13-18(28-19)14-7-5-4-6-8-14)22-20(23)15-9-11-16(12-10-15)29(2,25)26/h4-13H,3H2,1-2H3,(H,22,23)