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5-[(6-methylpyridin-3-yl)methyl]-2-(4-phenylbutoxy)-1H-pyrimidin-6-one
5-[(6-methylpyridin-3-yl)methyl]-2-(4-phenylbutoxy)-1H-pyrimidin-6-one
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Descriptors Computed from Structure
Canonical SMILES:
CC1=NC=C(C=C1)CC2=CN=C(NC2=O)OCCCCC3=CC=CC=C3
Isomeric SMILES
CC1=NC=C(C=C1)CC2=CN=C(NC2=O)OCCCCC3=CC=CC=C3
InChI
InChI=1S/C21H23N3O2/c1-16-10-11-18(14-22-16)13-19-15-23-21(24-20(19)25)26-12-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,10-11,14-15H,5-6,9,12-13H2,1H3,(H,23,24,25)
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