(NE)-N-[[2-azanyl-4-chloranyl-6-(4-phenylbutylamino)pyrimidin-5-yl]methylidene]hydroxylamine

Systemtic Name: (NE)-N-[[2-azanyl-4-chloranyl-6-(4-phenylbutylamino)pyrimidin-5-yl]methylidene]hydroxylamine Openeye Name: (5E)-2-amino-4-chloro-6-(4-phenylbutylamino)pyrimidine-5-carbaldehyde oxime CAS Name: (5E)-2-amino-4-chloro-6-(4-phenylbutylamino)-5-pyrimidinecarboxaldehyde oxime IUPAC Name: (NE)-N-[[2-amino-4-chloro-6-(4-phenylbutylamino)pyrimidin-5-yl]methylidene]hydroxylamine Traditional Name: (5E)-2-amino-4-chloro-6-(4-phenylbutylamino)pyrimidine-5-carbaldehyde oxime Formula: C15H18ClN5O MolecularWeight: 319.78932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNC2=C(C(=NC(=N2)N)Cl)C=NO

Isomeric SMILES

C1=CC=C(C=C1)CCCCNC2=C(C(=NC(=N2)N)Cl)/C=N/O

InChI

InChI=1S/C15H18ClN5O/c16-13-12(10-19-22)14(21-15(17)20-13)18-9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,10,22H,4-5,8-9H2,(H3,17,18,20,21)/b19-10+