2-(ethanoylsulfanylmethyl)-2-methyl-3-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]propanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-2-methyl-3-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]propanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-[6-(tert-butoxycarbonylamino)-3-pyridyl]-2-methyl-propanoic acid CAS Name: 2-[(acetylthio)methyl]-2-methyl-3-[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridinyl]propanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-2-methyl-3-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]propanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-[6-(tert-butoxycarbonylamino)-3-pyridyl]-2-methyl-propionic acid Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(C)(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC(=O)SCC(C)(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C17H24N2O5S/c1-11(20)25-10-17(5,14(21)22)8-12-6-7-13(18-9-12)19-15(23)24-16(2,3)4/h6-7,9H,8,10H2,1-5H3,(H,21,22)(H,18,19,23)