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

Systemtic Name: ethyl 3-methyl-5-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[4-(methylsulfonylmethyl)benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[4-(methylsulfonylmethyl)benzoyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[4-(mesylmethyl)benzoyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C

InChI

InChI=1S/C17H19NO5S2/c1-4-23-17(20)15-11(2)9-14(24-15)18-16(19)13-7-5-12(6-8-13)10-25(3,21)22/h5-9H,4,10H2,1-3H3,(H,18,19)