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6,7-dimethoxy-2-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline
6,7-dimethoxy-2-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C2CN(CCC2=C1)C3CCCN(C3)CC4=CC=CN4C5=NC=CC=N5)OC
Isomeric SMILES
COC1=C(C=C2CN(CCC2=C1)C3CCCN(C3)CC4=CC=CN4C5=NC=CC=N5)OC
InChI
InChI=1S/C25H31N5O2/c1-31-23-14-19-8-13-29(16-20(19)15-24(23)32-2)21-6-3-11-28(17-21)18-22-7-4-12-30(22)25-26-9-5-10-27-25/h4-5,7,9-10,12,14-15,21H,3,6,8,11,13,16-18H2,1-2H3
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