[1-(2-methoxyethanethioyl)piperidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamic acid

Systemtic Name: [1-(2-methoxyethanethioyl)piperidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamic acid Openeye Name: (tert-butoxycarbonylamino)-[1-(2-methoxyethanethioyl)-4-piperidyl]carbamic acid CAS Name: [1-(2-methoxy-1-sulfanylideneethyl)-4-piperidinyl]-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]carbamic acid IUPAC Name: [1-(2-methoxyethanethioyl)piperidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamic acid Traditional Name: (tert-butoxycarbonylamino)-[1-(2-methoxythioacetyl)-4-piperidyl]carbamic acid Formula: C14H25N3O5S MolecularWeight: 347.4304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(C1CCN(CC1)C(=S)COC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NN(C1CCN(CC1)C(=S)COC)C(=O)O

InChI

InChI=1S/C14H25N3O5S/c1-14(2,3)22-12(18)15-17(13(19)20)10-5-7-16(8-6-10)11(23)9-21-4/h10H,5-9H2,1-4H3,(H,15,18)(H,19,20)