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

Systemtic Name: 4-[2-[2-[(6-azanyl-5-nitro-pyridin-2-yl)amino]ethylamino]-5-(1H-imidazol-2-yl)pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-5-(1H-imidazol-2-yl)pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridinyl)amino]ethylamino]-5-(1H-imidazol-2-yl)-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-[2-[(6-amino-5-nitropyridin-2-yl)amino]ethylamino]-5-(1H-imidazol-2-yl)pyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-5-(1H-imidazol-2-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=NC=CN3)NCCNC4=NC(=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

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

InChI

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