ethyl 4-azanyl-2-[2-[(5-ethanoyl-2-ethoxy-phenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[(5-ethanoyl-2-ethoxy-phenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-[(5-acetyl-2-ethoxy-phenyl)methoxy]-2-oxo-ethyl]sulfanyl-4-amino-pyrimidine-5-carboxylate CAS Name: 2-[[2-[(5-acetyl-2-ethoxyphenyl)methoxy]-2-oxoethyl]thio]-4-amino-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-acetyl-2-ethoxyphenyl)methoxy]-2-oxoethyl]sulfanyl-4-aminopyrimidine-5-carboxylate Traditional Name: 2-[[2-(5-acetyl-2-ethoxy-benzyl)oxy-2-keto-ethyl]thio]-4-amino-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC

InChI

InChI=1S/C20H23N3O6S/c1-4-27-16-7-6-13(12(3)24)8-14(16)10-29-17(25)11-30-20-22-9-15(18(21)23-20)19(26)28-5-2/h6-9H,4-5,10-11H2,1-3H3,(H2,21,22,23)