methyl 3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C18H20N2O6S2 MolecularWeight: 424.4912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(SC=C2)C(=O)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(SC=C2)C(=O)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H20N2O6S2/c1-25-14-6-5-12(11-15(14)28(23,24)20-8-3-4-9-20)17(21)19-13-7-10-27-16(13)18(22)26-2/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,19,21)