6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-N-prop-2-enyl-pyrimidin-4-amine

Systemtic Name: 6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-N-prop-2-enyl-pyrimidin-4-amine Openeye Name: N-allyl-6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(2-fluorophenyl)-1-piperazinyl]-5-nitro-N-prop-2-enyl-4-pyrimidinamine IUPAC Name: 6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-N-prop-2-enylpyrimidin-4-amine Traditional Name: allyl-[6-[4-(2-fluorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]amine Formula: C17H19FN6O2 MolecularWeight: 358.370163

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

C=CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C17H19FN6O2/c1-2-7-19-16-15(24(25)26)17(21-12-20-16)23-10-8-22(9-11-23)14-6-4-3-5-13(14)18/h2-6,12H,1,7-11H2,(H,19,20,21)