N-(2-chloranyl-4,5-dimethoxy-phenyl)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC)Cl)OC

InChI

InChI=1S/C20H21ClN2O4S/c1-26-17-9-15(21)16(10-18(17)27-2)22-20(25)12-7-19(24)23(11-12)13-5-4-6-14(8-13)28-3/h4-6,8-10,12H,7,11H2,1-3H3,(H,22,25)