3-(3,4-dimethoxyphenyl)propyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-(3,4-dimethoxyphenyl)propyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(3,4-dimethoxyphenyl)propyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(3,4-dimethoxyphenyl)propyl ester IUPAC Name: 3-(3,4-dimethoxyphenyl)propyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(3,4-dimethoxyphenyl)propyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H22N2O4S/c1-11-13(10-18-17(24)19-11)16(20)23-8-4-5-12-6-7-14(21-2)15(9-12)22-3/h6-7,9H,4-5,8,10H2,1-3H3,(H2,18,19,24)