tert-butyl hydrogen carbonate; 1H-pyrimidine-2-thione

Systemtic Name: tert-butyl hydrogen carbonate; 1H-pyrimidine-2-thione Openeye Name: tert-butyl hydrogen carbonate; 1H-pyrimidine-2-thione CAS Name: carbonic acid tert-butyl ester; 1H-pyrimidine-2-thione IUPAC Name: tert-butyl hydrogen carbonate; 1H-pyrimidine-2-thione Traditional Name: carbonic acid tert-butyl ester; 1H-pyrimidine-2-thione Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)O.C1=CNC(=S)N=C1

Isomeric SMILES

CC(C)(C)OC(=O)O.C1=CNC(=S)N=C1

InChI

InChI=1S/C5H10O3.C4H4N2S/c1-5(2,3)8-4(6)7;7-4-5-2-1-3-6-4/h1-3H3,(H,6,7);1-3H,(H,5,6,7)