methyl 3-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propanoate

Systemtic Name: methyl 3-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-(3-furyl)-3-sulfanyl-propanoate CAS Name: 3-(3-furanyl)-3-mercapto-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3-furyl)-3-mercapto-propionic acid methyl ester Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(C1=COC=C1)S)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(C1=COC=C1)S)C(=O)OC

InChI

InChI=1S/C13H19NO5S/c1-13(2,3)19-12(16)14-9(11(15)17-4)10(20)8-5-6-18-7-8/h5-7,9-10,20H,1-4H3,(H,14,16)