(NE)-N-[[4-azanyl-6-[[(1S)-1-phenylethyl]amino]pyrimidin-5-yl]methylidene]hydroxylamine

Systemtic Name: (NE)-N-[[4-azanyl-6-[[(1S)-1-phenylethyl]amino]pyrimidin-5-yl]methylidene]hydroxylamine Openeye Name: (5E)-4-amino-6-[[(1S)-1-phenylethyl]amino]pyrimidine-5-carbaldehyde oxime CAS Name: (5E)-4-amino-6-[[(1S)-1-phenylethyl]amino]-5-pyrimidinecarboxaldehyde oxime IUPAC Name: (NE)-N-[[4-amino-6-[[(1S)-1-phenylethyl]amino]pyrimidin-5-yl]methylidene]hydroxylamine Traditional Name: (5E)-4-amino-6-[[(1S)-1-phenylethyl]amino]pyrimidine-5-carbaldehyde oxime Formula: C13H15N5O MolecularWeight: 257.2911

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC(=C2C=NO)N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC2=NC=NC(=C2/C=N/O)N

InChI

InChI=1S/C13H15N5O/c1-9(10-5-3-2-4-6-10)18-13-11(7-17-19)12(14)15-8-16-13/h2-9,19H,1H3,(H3,14,15,16,18)/b17-7+/t9-/m0/s1