N-(2,4-dimethoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(2,4-dimethoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine Openeye Name: N-(2,4-dimethoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine CAS Name: N-(2,4-dimethoxyphenyl)-6-[4-(4-methoxyphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinamine IUPAC Name: N-(2,4-dimethoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitropyrimidin-4-amine Traditional Name: (2,4-dimethoxyphenyl)-[6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidin-4-yl]amine Formula: C23H26N6O5 MolecularWeight: 466.48974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=C(C=C(C=C4)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=C(C=C(C=C4)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H26N6O5/c1-32-17-6-4-16(5-7-17)27-10-12-28(13-11-27)23-21(29(30)31)22(24-15-25-23)26-19-9-8-18(33-2)14-20(19)34-3/h4-9,14-15H,10-13H2,1-3H3,(H,24,25,26)