2-ethoxyethyl (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-ethoxyethyl (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-ethoxyethyl (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-ethoxyethyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=C(NC(=S)NC1C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOCCOC(=O)C1=C(NC(=S)N[C@@H]1C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H20N2O5S/c1-3-21-6-7-22-16(20)14-10(2)18-17(25)19-15(14)11-4-5-12-13(8-11)24-9-23-12/h4-5,8,15H,3,6-7,9H2,1-2H3,(H2,18,19,25)/t15-/m1/s1