ethyl 2-[[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[4-chloro-3-(2-oxo-1-pyrrolidinyl)phenyl]-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[4-chloro-3-(2-ketopyrrolidino)benzoyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2O4S/c1-3-13-11-14(20(26)27-4-2)19(28-13)22-18(25)12-7-8-15(21)16(10-12)23-9-5-6-17(23)24/h7-8,10-11H,3-6,9H2,1-2H3,(H,22,25)