N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]ethanamide

Systemtic Name: N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]ethanamide Openeye Name: N-[4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]phenyl]acetamide CAS Name: N-[4-[2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]acetamide Traditional Name: N-[4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]phenyl]acetamide Formula: C19H19N7O3 MolecularWeight: 393.39926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N7O3/c1-13(27)24-15-4-2-14(3-5-15)17-8-9-21-19(25-17)22-11-10-20-18-7-6-16(12-23-18)26(28)29/h2-9,12H,10-11H2,1H3,(H,20,23)(H,24,27)(H,21,22,25)