2-azanylidene-5-(4-chloranyl-3-nitro-phenyl)-6-ethyl-1-oxidanyl-pyrimidin-4-amine

Systemtic Name: 2-azanylidene-5-(4-chloranyl-3-nitro-phenyl)-6-ethyl-1-oxidanyl-pyrimidin-4-amine Openeye Name: 5-(4-chloro-3-nitro-phenyl)-6-ethyl-1-hydroxy-2-imino-pyrimidin-4-amine CAS Name: 5-(4-chloro-3-nitrophenyl)-6-ethyl-1-hydroxy-2-imino-4-pyrimidinamine IUPAC Name: 5-(4-chloro-3-nitrophenyl)-6-ethyl-1-hydroxy-2-iminopyrimidin-4-amine Traditional Name: [5-(4-chloro-3-nitro-phenyl)-6-ethyl-1-hydroxy-2-imino-pyrimidin-4-yl]amine Formula: C12H12ClN5O3 MolecularWeight: 309.70838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N)N1O)N)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=NC(=N)N1O)N)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN5O3/c1-2-8-10(11(14)16-12(15)17(8)19)6-3-4-7(13)9(5-6)18(20)21/h3-5,19H,2H2,1H3,(H3,14,15,16)