diethyl 2-[[(4-methyl-6-oxidanylidene-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(4-methyl-6-oxidanylidene-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-methyl-6-oxo-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylene]propanedioate CAS Name: 2-[[(4-methyl-6-oxo-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-methyl-6-oxo-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(6-keto-4-methyl-2-phenyl-5H-pyrrolo[2,3-d]pyrimidin-7-yl)amino]methylene]malonic acid diethyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNN1C(=O)CC2=C(N=C(N=C21)C3=CC=CC=C3)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNN1C(=O)CC2=C(N=C(N=C21)C3=CC=CC=C3)C)C(=O)OCC

InChI

InChI=1S/C21H22N4O5/c1-4-29-20(27)16(21(28)30-5-2)12-22-25-17(26)11-15-13(3)23-18(24-19(15)25)14-9-7-6-8-10-14/h6-10,12,22H,4-5,11H2,1-3H3