tert-butyl 2-[4-[(3-chlorophenyl)carbonylamino]-6-oxidanylidene-2-phenyl-pyrimidin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-[(3-chlorophenyl)carbonylamino]-6-oxidanylidene-2-phenyl-pyrimidin-1-yl]ethanoate Openeye Name: tert-butyl 2-[4-[(3-chlorobenzoyl)amino]-6-oxo-2-phenyl-pyrimidin-1-yl]acetate CAS Name: 2-[4-[[(3-chlorophenyl)-oxomethyl]amino]-6-oxo-2-phenyl-1-pyrimidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(3-chlorobenzoyl)amino]-6-oxo-2-phenylpyrimidin-1-yl]acetate Traditional Name: 2-[4-[(3-chlorobenzoyl)amino]-6-keto-2-phenyl-pyrimidin-1-yl]acetic acid tert-butyl ester Formula: C23H22ClN3O4 MolecularWeight: 439.89148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=O)C=C(N=C1C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=O)C=C(N=C1C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H22ClN3O4/c1-23(2,3)31-20(29)14-27-19(28)13-18(25-21(27)15-8-5-4-6-9-15)26-22(30)16-10-7-11-17(24)12-16/h4-13H,14H2,1-3H3,(H,26,30)