O1-tert-butyl O4-(2-sulfanylidenepyridin-1-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O1-tert-butyl O4-(2-sulfanylidenepyridin-1-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O1-tert-butyl O4-(2-thioxo-1-pyridyl) (2S)-2-(tert-butoxycarbonylamino)butanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O1-tert-butyl ester O4-(2-sulfanylidene-1-pyridinyl) ester IUPAC Name: 1-O-tert-butyl 4-O-(2-sulfanylidenepyridin-1-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)succinic acid O1-tert-butyl ester O4-(2-thioxo-1-pyridyl) ester Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(=O)ON1C=CC=CC1=S)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC(=O)ON1C=CC=CC1=S)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N2O6S/c1-17(2,3)24-15(22)12(19-16(23)25-18(4,5)6)11-14(21)26-20-10-8-7-9-13(20)27/h7-10,12H,11H2,1-6H3,(H,19,23)/t12-/m0/s1