ethyl 5-azanyl-1-[5,6-dimethyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-yl]-3-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[5,6-dimethyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-yl]-3-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-(7-benzyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-amino-1-[5,6-dimethyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinyl]-3-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-(7-benzyl-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-yl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-amino-1-(7-benzyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl)-3-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=NC=NC3=C2C(=C(N3CC4=CC=CC=C4)C)C)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=NC=NC3=C2C(=C(N3CC4=CC=CC=C4)C)C)N

InChI

InChI=1S/C22H24N6O2/c1-5-30-22(29)18-14(3)26-28(19(18)23)21-17-13(2)15(4)27(20(17)24-12-25-21)11-16-9-7-6-8-10-16/h6-10,12H,5,11,23H2,1-4H3