[2-(2-azanylpropan-2-yl)-4-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-6-oxidanylidene-pyrimidin-5-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-(2-azanylpropan-2-yl)-4-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-6-oxidanylidene-pyrimidin-5-yl] 2,2-dimethylpropanoate Openeye Name: [2-(1-amino-1-methyl-ethyl)-4-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-6-oxo-pyrimidin-5-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-(2-aminopropan-2-yl)-4-[[(4-fluorophenyl)methylamino]-oxomethyl]-1-methyl-6-oxo-5-pyrimidinyl] ester IUPAC Name: [2-(2-aminopropan-2-yl)-4-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-6-oxopyrimidin-5-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-(1-amino-1-methyl-ethyl)-4-[(4-fluorobenzyl)carbamoyl]-6-keto-1-methyl-pyrimidin-5-yl] ester Formula: C21H27FN4O4 MolecularWeight: 418.461883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(N=C(N(C1=O)C)C(C)(C)N)C(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(N=C(N(C1=O)C)C(C)(C)N)C(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H27FN4O4/c1-20(2,3)19(29)30-15-14(25-18(21(4,5)23)26(6)17(15)28)16(27)24-11-12-7-9-13(22)10-8-12/h7-10H,11,23H2,1-6H3,(H,24,27)