(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 5-chloranyl-2-(furan-2-ylmethylamino)pyrimidine-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 5-chloranyl-2-(furan-2-ylmethylamino)pyrimidine-4-carboxylate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 5-chloro-2-(2-furylmethylamino)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(2-furanylmethylamino)-4-pyrimidinecarboxylic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 5-chloro-2-(furan-2-ylmethylamino)pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(2-furfurylamino)pyrimidine-4-carboxylic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=NC(=NC=C2Cl)NCC3=CC=CO3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=NC(=NC=C2Cl)NCC3=CC=CO3

InChI

InChI=1S/C19H17ClN4O4/c1-12(17(25)23-13-6-3-2-4-7-13)28-18(26)16-15(20)11-22-19(24-16)21-10-14-8-5-9-27-14/h2-9,11-12H,10H2,1H3,(H,23,25)(H,21,22,24)