tert-butyl 5-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]-2-sulfanylidene-1H-imidazole-3-carboxylate

Systemtic Name: tert-butyl 5-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]-2-sulfanylidene-1H-imidazole-3-carboxylate Openeye Name: tert-butyl 5-[(2S)-2-(tert-butoxycarbonylamino)-3-methoxy-3-oxo-propyl]-2-thioxo-1H-imidazole-3-carboxylate CAS Name: 5-[(2S)-3-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]-2-sulfanylidene-1H-imidazole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]-2-sulfanylidene-1H-imidazole-3-carboxylate Traditional Name: 4-[(2S)-2-(tert-butoxycarbonylamino)-3-keto-3-methoxy-propyl]-2-thioxo-4-imidazoline-1-carboxylic acid tert-butyl ester Formula: C17H27N3O6S MolecularWeight: 401.47778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CN(C(=S)N1)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C17H27N3O6S/c1-16(2,3)25-14(22)19-11(12(21)24-7)8-10-9-20(13(27)18-10)15(23)26-17(4,5)6/h9,11H,8H2,1-7H3,(H,18,27)(H,19,22)/t11-/m0/s1