3-[[6-azanyl-8-methoxy-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]amino]propane-1,2-diol

Systemtic Name: 3-[[6-azanyl-8-methoxy-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]amino]propane-1,2-diol Openeye Name: 3-[[6-amino-8-methoxy-9-[(6-methyl-3-pyridyl)methyl]purin-2-yl]amino]propane-1,2-diol CAS Name: 3-[[6-amino-8-methoxy-9-[(6-methyl-3-pyridinyl)methyl]-2-purinyl]amino]propane-1,2-diol IUPAC Name: 3-[[6-amino-8-methoxy-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]amino]propane-1,2-diol Traditional Name: 3-[[6-amino-8-methoxy-9-[(6-methyl-3-pyridyl)methyl]purin-2-yl]amino]propane-1,2-diol Formula: C16H21N7O3 MolecularWeight: 359.38304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CN2C3=C(C(=NC(=N3)NCC(CO)O)N)N=C2OC

Isomeric SMILES

CC1=NC=C(C=C1)CN2C3=C(C(=NC(=N3)NCC(CO)O)N)N=C2OC

InChI

InChI=1S/C16H21N7O3/c1-9-3-4-10(5-18-9)7-23-14-12(20-16(23)26-2)13(17)21-15(22-14)19-6-11(25)8-24/h3-5,11,24-25H,6-8H2,1-2H3,(H3,17,19,21,22)