ethyl 4-[(2-chlorophenyl)methylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(2-chlorophenyl)methylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(2-chlorophenyl)methylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-[(2-chlorophenyl)methylamino]-2,6-dimethyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chlorophenyl)methylamino]-2,6-dimethylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-[(2-chlorobenzyl)amino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NCC3=CC=CC=C3Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NCC3=CC=CC=C3Cl)C)C

InChI

InChI=1S/C18H18ClN3O3/c1-4-24-18(23)14-10(2)25-17-15(14)16(21-11(3)22-17)20-9-12-7-5-6-8-13(12)19/h5-8H,4,9H2,1-3H3,(H,20,21,22)