ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[3-(1,3-benzothiazol-2-yl)-1-oxopropoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N3O5S/c1-2-25-17(23)11-9-19-18(24)21-13(11)10-26-16(22)8-7-15-20-12-5-3-4-6-14(12)27-15/h3-6H,2,7-10H2,1H3,(H2,19,21,24)