4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]benzamide

Systemtic Name: 4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]benzamide Openeye Name: 4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]benzamide CAS Name: 4-[2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-pyrimidinyl]benzamide IUPAC Name: 4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]benzamide Traditional Name: 4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]benzamide Formula: C18H17N7O3 MolecularWeight: 379.37268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2)NCCNC3=NC=C(C=C3)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2)NCCNC3=NC=C(C=C3)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C18H17N7O3/c19-17(26)13-3-1-12(2-4-13)15-7-8-21-18(24-15)22-10-9-20-16-6-5-14(11-23-16)25(27)28/h1-8,11H,9-10H2,(H2,19,26)(H,20,23)(H,21,22,24)