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7-but-2-ynyl-1-methyl-2-methylsulfanyl-8-piperazin-1-yl-purin-6-one

7-but-2-ynyl-1-methyl-2-methylsulfanyl-8-piperazin-1-yl-purin-6-one

Systemtic Name:7-but-2-ynyl-1-methyl-2-methylsulfanyl-8-piperazin-1-yl-purin-6-one
Openeye Name:7-but-2-ynyl-1-methyl-2-methylsulfanyl-8-piperazin-1-yl-purin-6-one
CAS Name:7-but-2-ynyl-1-methyl-2-(methylthio)-8-(1-piperazinyl)-6-purinone
IUPAC Name:7-but-2-ynyl-1-methyl-2-methylsulfanyl-8-piperazin-1-ylpurin-6-one
Traditional Name:7-but-2-ynyl-1-methyl-2-(methylthio)-8-piperazino-purin-6-one
Formula: C15H20N6OS
MolecularWeight: 332.4239
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H20N6OS/c1-4-5-8-21-11-12(18-15(23-3)19(2)13(11)22)17-14(21)20-9-6-16-7-10-20/h16H,6-10H2,1-3H3


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