tert-butyl N-[(2S)-3-methyl-1-oxidanylidene-1-[(1-pyrimidin-5-ylimidazol-4-yl)amino]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-methyl-1-oxidanylidene-1-[(1-pyrimidin-5-ylimidazol-4-yl)amino]butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-methyl-1-[(1-pyrimidin-5-ylimidazol-4-yl)carbamoyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-oxo-1-[[1-(5-pyrimidinyl)-4-imidazolyl]amino]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-methyl-1-oxo-1-[(1-pyrimidin-5-ylimidazol-4-yl)amino]butan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[[1-(5-pyrimidyl)imidazol-4-yl]carbamoyl]propyl]carbamic acid tert-butyl ester Formula: C17H24N6O3 MolecularWeight: 360.41086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CN(C=N1)C2=CN=CN=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CN(C=N1)C2=CN=CN=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H24N6O3/c1-11(2)14(22-16(25)26-17(3,4)5)15(24)21-13-8-23(10-20-13)12-6-18-9-19-7-12/h6-11,14H,1-5H3,(H,21,24)(H,22,25)/t14-/m0/s1