tert-butyl 4-[7-but-2-ynyl-2-chloranyl-6-oxidanylidene-1-(2-trimethylsilylethoxymethyl)purin-8-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[7-but-2-ynyl-2-chloranyl-6-oxidanylidene-1-(2-trimethylsilylethoxymethyl)purin-8-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[7-but-2-ynyl-2-chloro-6-oxo-1-(2-trimethylsilylethoxymethyl)purin-8-yl]piperazine-1-carboxylate CAS Name: 4-[7-but-2-ynyl-2-chloro-6-oxo-1-(2-trimethylsilylethoxymethyl)-8-purinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[7-but-2-ynyl-2-chloro-6-oxo-1-(2-trimethylsilylethoxymethyl)purin-8-yl]piperazine-1-carboxylate Traditional Name: 4-[7-but-2-ynyl-2-chloro-6-keto-1-(2-trimethylsilylethoxymethyl)purin-8-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H37ClN6O4Si MolecularWeight: 537.12688

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(N=C1N3CCN(CC3)C(=O)OC(C)(C)C)N=C(N(C2=O)COCC[Si](C)(C)C)Cl

Isomeric SMILES

CC#CCN1C2=C(N=C1N3CCN(CC3)C(=O)OC(C)(C)C)N=C(N(C2=O)COCC[Si](C)(C)C)Cl

InChI

InChI=1S/C24H37ClN6O4Si/c1-8-9-10-30-18-19(26-21(25)31(20(18)32)17-34-15-16-36(5,6)7)27-22(30)28-11-13-29(14-12-28)23(33)35-24(2,3)4/h10-17H2,1-7H3