ethyl 4-cyano-3-methyl-5-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[[(3S)-5-oxo-1-phenyl-pyrrolidine-3-carbonyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[[(3S)-5-oxo-1-phenylpyrrolidine-3-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-5-[[(3S)-5-keto-1-phenyl-pyrrolidine-3-carbonyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3)C#N)C

InChI

InChI=1S/C20H19N3O4S/c1-3-27-20(26)17-12(2)15(10-21)19(28-17)22-18(25)13-9-16(24)23(11-13)14-7-5-4-6-8-14/h4-8,13H,3,9,11H2,1-2H3,(H,22,25)/t13-/m0/s1