ethyl 3-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-[(4-chloro-3-methylsulfonyl-benzoyl)amino]-5-(4-methoxyphenyl)thiophene-2-carboxylate CAS Name: 3-[[(4-chloro-3-methylsulfonylphenyl)-oxomethyl]amino]-5-(4-methoxyphenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-chloro-3-methylsulfonylbenzoyl)amino]-5-(4-methoxyphenyl)thiophene-2-carboxylate Traditional Name: 3-[(4-chloro-3-mesyl-benzoyl)amino]-5-(4-methoxyphenyl)thiophene-2-carboxylic acid ethyl ester Formula: C22H20ClNO6S2 MolecularWeight: 493.9803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClNO6S2/c1-4-30-22(26)20-17(12-18(31-20)13-5-8-15(29-2)9-6-13)24-21(25)14-7-10-16(23)19(11-14)32(3,27)28/h5-12H,4H2,1-3H3,(H,24,25)