ethyl 4-[2-[(4-aminocarbonylphenyl)amino]pyrimidin-4-yl]benzoate

Systemtic Name: ethyl 4-[2-[(4-aminocarbonylphenyl)amino]pyrimidin-4-yl]benzoate Openeye Name: ethyl 4-[2-(4-carbamoylanilino)pyrimidin-4-yl]benzoate CAS Name: 4-[2-(4-carbamoylanilino)-4-pyrimidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-carbamoylanilino)pyrimidin-4-yl]benzoate Traditional Name: 4-[2-(4-carbamoylanilino)pyrimidin-4-yl]benzoic acid ethyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H18N4O3/c1-2-27-19(26)15-5-3-13(4-6-15)17-11-12-22-20(24-17)23-16-9-7-14(8-10-16)18(21)25/h3-12H,2H2,1H3,(H2,21,25)(H,22,23,24)