N2,N4-bis[bis(4-methoxyphenyl)methyl]-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis[bis(4-methoxyphenyl)methyl]-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis[bis(4-methoxyphenyl)methyl]-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis[bis(4-methoxyphenyl)methyl]-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis[bis(4-methoxyphenyl)methyl]-5-fluoropyrimidine-2,4-diamine Traditional Name: bis(4-methoxyphenyl)methyl-[2-[bis(4-methoxyphenyl)methylamino]-5-fluoro-pyrimidin-4-yl]amine Formula: C34H33FN4O4 MolecularWeight: 580.648623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC3=NC(=NC=C3F)NC(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC3=NC(=NC=C3F)NC(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C34H33FN4O4/c1-40-26-13-5-22(6-14-26)31(23-7-15-27(41-2)16-8-23)37-33-30(35)21-36-34(39-33)38-32(24-9-17-28(42-3)18-10-24)25-11-19-29(43-4)20-12-25/h5-21,31-32H,1-4H3,(H2,36,37,38,39)