3,6-dimethyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 3,6-dimethyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 3,6-dimethyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 3,6-dimethyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 3,6-dimethyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 3,6-dimethyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=S)N1)C)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(C(N(C(=S)N1)C)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

InChI

InChI=1S/C16H20N2O5S/c1-8-12(15(19)20)13(18(2)16(24)17-8)9-6-10(21-3)14(23-5)11(7-9)22-4/h6-7,13H,1-5H3,(H,17,24)(H,19,20)