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2,6-dimethyl-7-(phenylmethyl)-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride
2,6-dimethyl-7-(phenylmethyl)-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C2=C(N1)C(=NC(=N2)C)N3CCCCC3)CC4=CC=CC=C4.O.Cl
Isomeric SMILES
CC1=C(C2=C(N1)C(=NC(=N2)C)N3CCCCC3)CC4=CC=CC=C4.O.Cl
InChI
InChI=1S/C20H24N4.ClH.H2O/c1-14-17(13-16-9-5-3-6-10-16)18-19(21-14)20(23-15(2)22-18)24-11-7-4-8-12-24;;/h3,5-6,9-10,21H,4,7-8,11-13H2,1-2H3;1H;1H2
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