1-[4-(2-fluoranyl-4-nitro-phenoxy)pyridin-2-yl]-3-(4-methylpiperazin-1-yl)urea

Systemtic Name: 1-[4-(2-fluoranyl-4-nitro-phenoxy)pyridin-2-yl]-3-(4-methylpiperazin-1-yl)urea Openeye Name: 1-[4-(2-fluoro-4-nitro-phenoxy)-2-pyridyl]-3-(4-methylpiperazin-1-yl)urea CAS Name: 1-[4-(2-fluoro-4-nitrophenoxy)-2-pyridinyl]-3-(4-methyl-1-piperazinyl)urea IUPAC Name: 1-[4-(2-fluoro-4-nitrophenoxy)pyridin-2-yl]-3-(4-methylpiperazin-1-yl)urea Traditional Name: 1-[4-(2-fluoro-4-nitro-phenoxy)-2-pyridyl]-3-(4-methylpiperazino)urea Formula: C17H19FN6O4 MolecularWeight: 390.368963

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)NC2=NC=CC(=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

CN1CCN(CC1)NC(=O)NC2=NC=CC(=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C17H19FN6O4/c1-22-6-8-23(9-7-22)21-17(25)20-16-11-13(4-5-19-16)28-15-3-2-12(24(26)27)10-14(15)18/h2-5,10-11H,6-9H2,1H3,(H2,19,20,21,25)