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

Systemtic Name: N-(2-methoxyethyl)-4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]benzamide Openeye Name: N-(2-methoxyethyl)-4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]benzamide CAS Name: N-(2-methoxyethyl)-4-[2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-pyrimidinyl]benzamide IUPAC Name: N-(2-methoxyethyl)-4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]benzamide Traditional Name: N-(2-methoxyethyl)-4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]benzamide Formula: C21H23N7O4 MolecularWeight: 437.45182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N7O4/c1-32-13-12-23-20(29)16-4-2-15(3-5-16)18-8-9-24-21(27-18)25-11-10-22-19-7-6-17(14-26-19)28(30)31/h2-9,14H,10-13H2,1H3,(H,22,26)(H,23,29)(H,24,25,27)