(6-cyano-7-methyl-2-phenyl-pyrrolo[2,3-d]pyrimidin-5-yl) ethanoate

Systemtic Name: (6-cyano-7-methyl-2-phenyl-pyrrolo[2,3-d]pyrimidin-5-yl) ethanoate Openeye Name: (6-cyano-7-methyl-2-phenyl-pyrrolo[2,3-d]pyrimidin-5-yl) acetate CAS Name: acetic acid (6-cyano-7-methyl-2-phenyl-5-pyrrolo[2,3-d]pyrimidinyl) ester IUPAC Name: (6-cyano-7-methyl-2-phenylpyrrolo[2,3-d]pyrimidin-5-yl) acetate Traditional Name: acetic acid (6-cyano-7-methyl-2-phenyl-pyrrolo[2,3-d]pyrimidin-5-yl) ester Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(N(C2=NC(=NC=C12)C3=CC=CC=C3)C)C#N

Isomeric SMILES

CC(=O)OC1=C(N(C2=NC(=NC=C12)C3=CC=CC=C3)C)C#N

InChI

InChI=1S/C16H12N4O2/c1-10(21)22-14-12-9-18-15(11-6-4-3-5-7-11)19-16(12)20(2)13(14)8-17/h3-7,9H,1-2H3