2-methoxyethyl (5R,6R)-4-methylidene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methoxyethyl (5R,6R)-4-methylidene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: 2-methoxyethyl (5R,6R)-4-methylene-2-thioxo-6-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-5-carboxylate CAS Name: (5R,6R)-4-methylene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (5R,6R)-4-methylidene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: (5R,6R)-4-methylene-2-thioxo-6-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C18H24N2O6S MolecularWeight: 396.45796

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1C(NC(=S)NC1=C)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

COCCOC(=O)[C@@H]1[C@@H](NC(=S)NC1=C)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C18H24N2O6S/c1-10-14(17(21)26-7-6-22-2)15(20-18(27)19-10)11-8-12(23-3)16(25-5)13(9-11)24-4/h8-9,14-15H,1,6-7H2,2-5H3,(H2,19,20,27)/t14-,15-/m0/s1