ethyl 4-chloranyl-5-methyl-7-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-chloranyl-5-methyl-7-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-chloro-5-methyl-7-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-chloro-5-methyl-7-phenyl-6-pyrrolo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-methyl-7-phenylpyrrolo[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-chloro-5-methyl-7-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C3=CC=CC=C3)N=CN=C2Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C3=CC=CC=C3)N=CN=C2Cl)C

InChI

InChI=1S/C16H14ClN3O2/c1-3-22-16(21)13-10(2)12-14(17)18-9-19-15(12)20(13)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3