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

Systemtic Name: ethyl 4-[(2,4-dichlorophenyl)amino]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2,4-dichloroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate CAS Name: 4-(2,4-dichloroanilino)-2-(3,5-dimethyl-1-pyrazolyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dichloroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-(2,4-dichloroanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester Formula: C18H17Cl2N5O2 MolecularWeight: 406.26588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=C(C=C(C=C2)Cl)Cl)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=C(C=C(C=C2)Cl)Cl)N3C(=CC(=N3)C)C

InChI

InChI=1S/C18H17Cl2N5O2/c1-4-27-17(26)13-9-21-18(25-11(3)7-10(2)24-25)23-16(13)22-15-6-5-12(19)8-14(15)20/h5-9H,4H2,1-3H3,(H,21,22,23)