4-[2-[2-[(6-azanyl-5-nitro-pyridin-2-yl)amino]ethylamino]-5-(1H-imidazol-5-yl)pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[2-[(6-azanyl-5-nitro-pyridin-2-yl)amino]ethylamino]-5-(1H-imidazol-5-yl)pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-5-(1H-imidazol-5-yl)pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridinyl)amino]ethylamino]-5-(1H-imidazol-5-yl)-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-[2-[(6-amino-5-nitropyridin-2-yl)amino]ethylamino]-5-(1H-imidazol-5-yl)pyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-5-(1H-imidazol-5-yl)pyrimidin-4-yl]benzonitrile Formula: C21H18N10O2 MolecularWeight: 442.43342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=NC(=NC=C2C3=CN=CN3)NCCNC4=NC(=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=NC(=NC=C2C3=CN=CN3)NCCNC4=NC(=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C21H18N10O2/c22-9-13-1-3-14(4-2-13)19-15(16-11-24-12-28-16)10-27-21(30-19)26-8-7-25-18-6-5-17(31(32)33)20(23)29-18/h1-6,10-12H,7-8H2,(H,24,28)(H3,23,25,29)(H,26,27,30)