2-phenyl-N-[[6-[(4-pyrrol-1-ylphthalazin-1-yl)oxymethyl]pyridin-2-yl]methyl]ethanamine

Systemtic Name: 2-phenyl-N-[[6-[(4-pyrrol-1-ylphthalazin-1-yl)oxymethyl]pyridin-2-yl]methyl]ethanamine Openeye Name: 2-phenyl-N-[[6-[(4-pyrrol-1-ylphthalazin-1-yl)oxymethyl]-2-pyridyl]methyl]ethanamine CAS Name: 2-phenyl-N-[[6-[[4-(1-pyrrolyl)-1-phthalazinyl]oxymethyl]-2-pyridinyl]methyl]ethanamine IUPAC Name: 2-phenyl-N-[[6-[(4-pyrrol-1-ylphthalazin-1-yl)oxymethyl]pyridin-2-yl]methyl]ethanamine Traditional Name: phenethyl-[[6-[(4-pyrrol-1-ylphthalazin-1-yl)oxymethyl]-2-pyridyl]methyl]amine Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC2=NC(=CC=C2)COC3=NN=C(C4=CC=CC=C43)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNCC2=NC(=CC=C2)COC3=NN=C(C4=CC=CC=C43)N5C=CC=C5

InChI

InChI=1S/C27H25N5O/c1-2-9-21(10-3-1)15-16-28-19-22-11-8-12-23(29-22)20-33-27-25-14-5-4-13-24(25)26(30-31-27)32-17-6-7-18-32/h1-14,17-18,28H,15-16,19-20H2