4-[4-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-1H-indole

Systemtic Name: 4-[4-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-1H-indole Openeye Name: 4-[4-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-1H-indole CAS Name: 4-[4-[6-[4-(2-fluorophenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-1-piperazinyl]-1H-indole IUPAC Name: 4-[4-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]piperazin-1-yl]-1H-indole Traditional Name: 4-[4-[6-[4-(2-fluorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]piperazino]-1H-indole Formula: C26H27FN8O2 MolecularWeight: 502.543383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=C2C=CN3)C4=C(C(=NC=N4)N5CCN(CC5)C6=CC=CC=C6F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=C2C=CN3)C4=C(C(=NC=N4)N5CCN(CC5)C6=CC=CC=C6F)[N+](=O)[O-]

InChI

InChI=1S/C26H27FN8O2/c27-20-4-1-2-6-23(20)32-12-16-34(17-13-32)26-24(35(36)37)25(29-18-30-26)33-14-10-31(11-15-33)22-7-3-5-21-19(22)8-9-28-21/h1-9,18,28H,10-17H2