ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H18N2O5S/c1-2-21-15(19)11-8-17-16(20)18-12(11)9-24-10-3-4-13-14(7-10)23-6-5-22-13/h3-4,7H,2,5-6,8-9H2,1H3,(H2,17,18,20)