7-but-2-ynyl-1-methyl-2-[methyl(propan-2-yl)amino]-8-piperazin-1-yl-purin-6-one

Systemtic Name: 7-but-2-ynyl-1-methyl-2-[methyl(propan-2-yl)amino]-8-piperazin-1-yl-purin-6-one Openeye Name: 7-but-2-ynyl-2-[isopropyl(methyl)amino]-1-methyl-8-piperazin-1-yl-purin-6-one CAS Name: 7-but-2-ynyl-1-methyl-2-[methyl(propan-2-yl)amino]-8-(1-piperazinyl)-6-purinone IUPAC Name: 7-but-2-ynyl-1-methyl-2-[methyl(propan-2-yl)amino]-8-piperazin-1-ylpurin-6-one Traditional Name: 7-but-2-ynyl-2-[isopropyl(methyl)amino]-1-methyl-8-piperazino-purin-6-one Formula: C18H27N7O MolecularWeight: 357.45328

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(N=C1N3CCNCC3)N=C(N(C2=O)C)N(C)C(C)C

Isomeric SMILES

CC#CCN1C2=C(N=C1N3CCNCC3)N=C(N(C2=O)C)N(C)C(C)C

InChI

InChI=1S/C18H27N7O/c1-6-7-10-25-14-15(21-18(25)24-11-8-19-9-12-24)20-17(22(4)13(2)3)23(5)16(14)26/h13,19H,8-12H2,1-5H3