ethyl 3-methyl-5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[(4-pyrrolidinosulfonylbenzoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C19H22N2O5S2/c1-3-26-19(23)17-13(2)12-16(27-17)20-18(22)14-6-8-15(9-7-14)28(24,25)21-10-4-5-11-21/h6-9,12H,3-5,10-11H2,1-2H3,(H,20,22)