1-[9-prop-2-enyl-6-(propylamino)purin-2-yl]piperidin-4-one

Systemtic Name: 1-[9-prop-2-enyl-6-(propylamino)purin-2-yl]piperidin-4-one Openeye Name: 1-[9-allyl-6-(propylamino)purin-2-yl]piperidin-4-one CAS Name: 1-[9-prop-2-enyl-6-(propylamino)-2-purinyl]-4-piperidinone IUPAC Name: 1-[9-prop-2-enyl-6-(propylamino)purin-2-yl]piperidin-4-one Traditional Name: 1-[9-allyl-6-(propylamino)purin-2-yl]-4-piperidone Formula: C16H22N6O MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC2=C1N=CN2CC=C)N3CCC(=O)CC3

Isomeric SMILES

CCCNC1=NC(=NC2=C1N=CN2CC=C)N3CCC(=O)CC3

InChI

InChI=1S/C16H22N6O/c1-3-7-17-14-13-15(22(8-4-2)11-18-13)20-16(19-14)21-9-5-12(23)6-10-21/h4,11H,2-3,5-10H2,1H3,(H,17,19,20)