tert-butyl hydrogen carbonate; 4,6-dimethyl-1H-pyrimidine-2-thione

Systemtic Name: tert-butyl hydrogen carbonate; 4,6-dimethyl-1H-pyrimidine-2-thione Openeye Name: tert-butyl hydrogen carbonate; 4,6-dimethyl-1H-pyrimidine-2-thione CAS Name: carbonic acid tert-butyl ester; 4,6-dimethyl-1H-pyrimidine-2-thione IUPAC Name: tert-butyl hydrogen carbonate; 4,6-dimethyl-1H-pyrimidine-2-thione Traditional Name: carbonic acid tert-butyl ester; 4,6-dimethyl-1H-pyrimidine-2-thione Formula: C11H18N2O3S MolecularWeight: 258.33722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=S)N1)C.CC(C)(C)OC(=O)O

Isomeric SMILES

CC1=CC(=NC(=S)N1)C.CC(C)(C)OC(=O)O

InChI

InChI=1S/C6H8N2S.C5H10O3/c1-4-3-5(2)8-6(9)7-4;1-5(2,3)8-4(6)7/h3H,1-2H3,(H,7,8,9);1-3H3,(H,6,7)