ethyl 3-(4-methoxy-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-7-yl)propanoate

Systemtic Name: ethyl 3-(4-methoxy-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-7-yl)propanoate Openeye Name: ethyl 3-(4-methoxy-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-7-yl)propanoate CAS Name: 3-[4-methoxy-2-(methylthio)-7-pyrrolo[2,3-d]pyrimidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-methoxy-2-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)propanoate Traditional Name: 3-[4-methoxy-2-(methylthio)pyrrolo[2,3-d]pyrimidin-7-yl]propionic acid ethyl ester Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C=CC2=C1N=C(N=C2OC)SC

Isomeric SMILES

CCOC(=O)CCN1C=CC2=C1N=C(N=C2OC)SC

InChI

InChI=1S/C13H17N3O3S/c1-4-19-10(17)6-8-16-7-5-9-11(16)14-13(20-3)15-12(9)18-2/h5,7H,4,6,8H2,1-3H3