butyl 4-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)amino]benzoate

Systemtic Name: butyl 4-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)amino]benzoate Openeye Name: butyl 4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]benzoate CAS Name: 4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]benzoate Traditional Name: 4-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)amino]benzoic acid butyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-2-3-13-27-20(26)16-9-11-17(12-10-16)22-21-23-18(14-19(25)24-21)15-7-5-4-6-8-15/h4-12,14H,2-3,13H2,1H3,(H2,22,23,24,25)