2-methoxy-9-propyl-1-prop-2-ynyl-purin-6-one

Systemtic Name: 2-methoxy-9-propyl-1-prop-2-ynyl-purin-6-one Openeye Name: 2-methoxy-9-propyl-1-prop-2-ynyl-purin-6-one CAS Name: 2-methoxy-9-propyl-1-prop-2-ynyl-6-purinone IUPAC Name: 2-methoxy-9-propyl-1-prop-2-ynylpurin-6-one Traditional Name: 2-methoxy-1-propargyl-9-propyl-purin-6-one Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N(C2=O)CC#C)OC

Isomeric SMILES

CCCN1C=NC2=C1N=C(N(C2=O)CC#C)OC

InChI

InChI=1S/C12H14N4O2/c1-4-6-15-8-13-9-10(15)14-12(18-3)16(7-5-2)11(9)17/h2,8H,4,6-7H2,1,3H3