N,N'-bis[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ethane-1,2-diamine

Systemtic Name: N,N'-bis[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ethane-1,2-diamine Openeye Name: N,N'-bis[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ethane-1,2-diamine CAS Name: N,N'-bis[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]ethane-1,2-diamine IUPAC Name: N,N'-bis[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]ethane-1,2-diamine Traditional Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylamino]ethyl]amine Formula: C36H36N6O2 MolecularWeight: 584.71004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2CNCCNCC3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2CNCCNCC3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H36N6O2/c1-43-33-17-13-27(14-18-33)35-29(25-41(39-35)31-9-5-3-6-10-31)23-37-21-22-38-24-30-26-42(32-11-7-4-8-12-32)40-36(30)28-15-19-34(44-2)20-16-28/h3-20,25-26,37-38H,21-24H2,1-2H3