ethyl 4-(furan-2-ylmethylamino)-2-(4-methylpyrazol-1-yl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(furan-2-ylmethylamino)-2-(4-methylpyrazol-1-yl)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-furylmethylamino)-2-(4-methylpyrazol-1-yl)pyrimidine-5-carboxylate CAS Name: 4-(2-furanylmethylamino)-2-(4-methyl-1-pyrazolyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-ylmethylamino)-2-(4-methylpyrazol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-(2-furfurylamino)-2-(4-methylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CO2)N3C=C(C=N3)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CO2)N3C=C(C=N3)C

InChI

InChI=1S/C16H17N5O3/c1-3-23-15(22)13-9-18-16(21-10-11(2)7-19-21)20-14(13)17-8-12-5-4-6-24-12/h4-7,9-10H,3,8H2,1-2H3,(H,17,18,20)