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

Systemtic Name: ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-4-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)-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=CC3=C(C=C2)OCCO3

InChI

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