(2-acetyloxy-7-carbamothioyl-5-methoxy-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl ethanoate

Systemtic Name: (2-acetyloxy-7-carbamothioyl-5-methoxy-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl ethanoate Openeye Name: (2-acetoxy-7-carbamothioyl-5-methoxy-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl acetate CAS Name: acetic acid (2-acetyloxy-7-carbamothioyl-5-methoxy-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl ester IUPAC Name: (2-acetyloxy-7-carbamothioyl-5-methoxy-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl acetate Traditional Name: acetic acid (2-acetoxy-5-methoxy-7-thiocarbamoyl-4-oxa-7-azabicyclo[4.1.0]heptan-3-yl)methyl ester Formula: C12H18N2O6S MolecularWeight: 318.34612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C2C(N2C(=S)N)C(O1)OC)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C2C(N2C(=S)N)C(O1)OC)OC(=O)C

InChI

InChI=1S/C12H18N2O6S/c1-5(15)18-4-7-10(19-6(2)16)8-9(11(17-3)20-7)14(8)12(13)21/h7-11H,4H2,1-3H3,(H2,13,21)