ethyl 5-ethyl-2-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O6S2 MolecularWeight: 466.57094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3)C(=O)OCC

InChI

InChI=1S/C21H26N2O6S2/c1-4-15-13-16(21(25)29-5-2)20(30-15)22-19(24)14-8-9-17(28-3)18(12-14)31(26,27)23-10-6-7-11-23/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,22,24)