ethyl 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]butanoate

Systemtic Name: ethyl 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]butanoate Openeye Name: ethyl 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]butanoate CAS Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]butanoate Traditional Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]butyric acid ethyl ester Formula: C15H17N5O2 MolecularWeight: 299.32778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)N1C=C(C=N1)C2=C3C=CNC3=NC=N2

Isomeric SMILES

CCOC(=O)CC(C)N1C=C(C=N1)C2=C3C=CNC3=NC=N2

InChI

InChI=1S/C15H17N5O2/c1-3-22-13(21)6-10(2)20-8-11(7-19-20)14-12-4-5-16-15(12)18-9-17-14/h4-5,7-10H,3,6H2,1-2H3,(H,16,17,18)