tert-butyl N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-sulfanylidene-pyran-2-yl)carbamate

Systemtic Name: tert-butyl N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-sulfanylidene-pyran-2-yl)carbamate Openeye Name: tert-butyl N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-thioxo-pyran-2-yl)carbamate CAS Name: N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-sulfanylidene-2-pyranyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-sulfanylidenepyran-2-yl)carbamate Traditional Name: N-(6-tert-butyl-5-cyano-3-dimethoxyphosphoryl-4-thioxo-pyran-2-yl)carbamic acid tert-butyl ester Formula: C17H25N2O6PS MolecularWeight: 416.428961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=S)C(=C(O1)NC(=O)OC(C)(C)C)P(=O)(OC)OC)C#N

Isomeric SMILES

CC(C)(C)C1=C(C(=S)C(=C(O1)NC(=O)OC(C)(C)C)P(=O)(OC)OC)C#N

InChI

InChI=1S/C17H25N2O6PS/c1-16(2,3)13-10(9-18)12(27)11(26(21,22-7)23-8)14(24-13)19-15(20)25-17(4,5)6/h1-8H3,(H,19,20)