methyl N-[4-azanyl-5-nitro-6-[[(2S)-1-oxidanylidene-1-phenyl-propan-2-yl]amino]pyrimidin-2-yl]carbamate

Systemtic Name: methyl N-[4-azanyl-5-nitro-6-[[(2S)-1-oxidanylidene-1-phenyl-propan-2-yl]amino]pyrimidin-2-yl]carbamate Openeye Name: methyl N-[4-amino-6-[[(1S)-1-methyl-2-oxo-2-phenyl-ethyl]amino]-5-nitro-pyrimidin-2-yl]carbamate CAS Name: N-[4-amino-5-nitro-6-[[(2S)-1-oxo-1-phenylpropan-2-yl]amino]-2-pyrimidinyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-amino-5-nitro-6-[[(2S)-1-oxo-1-phenylpropan-2-yl]amino]pyrimidin-2-yl]carbamate Traditional Name: N-[4-amino-6-[[(1S)-2-keto-1-methyl-2-phenyl-ethyl]amino]-5-nitro-pyrimidin-2-yl]carbamic acid methyl ester Formula: C15H16N6O5 MolecularWeight: 360.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC(=O)OC

Isomeric SMILES

C[C@@H](C(=O)C1=CC=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC(=O)OC

InChI

InChI=1S/C15H16N6O5/c1-8(11(22)9-6-4-3-5-7-9)17-13-10(21(24)25)12(16)18-14(19-13)20-15(23)26-2/h3-8H,1-2H3,(H4,16,17,18,19,20,23)/t8-/m0/s1