(3R)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-oxo-N-[4-(3-pyridyl)thiazol-2-yl]pyrrolidine-3-carboxamide CAS Name: (3R)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxo-N-[4-(3-pyridinyl)-2-thiazolyl]-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxo-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide Traditional Name: (3R)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-keto-N-[4-(3-pyridyl)thiazol-2-yl]pyrrolidine-3-carboxamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N2CC(CC2=O)C(=O)NC3=NC(=CS3)C4=CN=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1N2C[C@@H](CC2=O)C(=O)NC3=NC(=CS3)C4=CN=CC=C4)Cl)OC

InChI

InChI=1S/C21H19ClN4O4S/c1-29-17-8-18(30-2)16(7-14(17)22)26-10-13(6-19(26)27)20(28)25-21-24-15(11-31-21)12-4-3-5-23-9-12/h3-5,7-9,11,13H,6,10H2,1-2H3,(H,24,25,28)/t13-/m1/s1