ethyl 4-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-pyrrolidine-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methyl]-2-thioxo-pyrrolidine-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidenepyrrolidine-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-thioxo-3-veratryl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CNC1=S)C2=CC(=C(C=C2)OC)OC)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1(C(CNC1=S)C2=CC(=C(C=C2)OC)OC)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H29NO6S/c1-6-31-23(26)24(13-15-7-9-18(27-2)20(11-15)29-4)17(14-25-22(24)32)16-8-10-19(28-3)21(12-16)30-5/h7-12,17H,6,13-14H2,1-5H3,(H,25,32)