1-[6-(prop-2-enylamino)-9-propyl-purin-2-yl]piperidin-4-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N=C2NCC=C)N3CCC(=O)CC3

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2NCC=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/h3,11H,1,4-10H2,2H3,(H,17,19,20)