N-[2-[(6-ethyl-2-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amino]ethyl]ethanamide

Systemtic Name: N-[2-[(6-ethyl-2-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amino]ethyl]ethanamide Openeye Name: N-[2-[(6-ethyl-2-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amino]ethyl]acetamide CAS Name: N-[2-[[6-ethyl-2-(1-imidazolyl)-5-nitro-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[(6-ethyl-2-imidazol-1-yl-5-nitropyrimidin-4-yl)amino]ethyl]acetamide Traditional Name: N-[2-[(6-ethyl-2-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amino]ethyl]acetamide Formula: C13H17N7O3 MolecularWeight: 319.31918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N2C=CN=C2)NCCNC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=NC(=N1)N2C=CN=C2)NCCNC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H17N7O3/c1-3-10-11(20(22)23)12(16-5-4-15-9(2)21)18-13(17-10)19-7-6-14-8-19/h6-8H,3-5H2,1-2H3,(H,15,21)(H,16,17,18)