ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[(1R)-1-phenylethyl]amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[(1R)-1-phenylethyl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[(1R)-1-phenylethyl]amino]pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-[[(1R)-1-phenylethyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[(1R)-1-phenylethyl]amino]pyrimidine-5-carboxylate Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-4-[[(1R)-1-phenylethyl]amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC(C)C2=CC=CC=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N[C@H](C)C2=CC=CC=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C20H23N5O2/c1-5-27-19(26)17-12-21-20(25-14(3)11-13(2)24-25)23-18(17)22-15(4)16-9-7-6-8-10-16/h6-12,15H,5H2,1-4H3,(H,21,22,23)/t15-/m1/s1