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

Systemtic Name: ethyl 5-ethyl-2-[(3-methylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(3-methylsulfonylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(3-methylsulfonylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(3-mesylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C17H19NO5S2/c1-4-12-10-14(17(20)23-5-2)16(24-12)18-15(19)11-7-6-8-13(9-11)25(3,21)22/h6-10H,4-5H2,1-3H3,(H,18,19)