2-(ethanoylsulfanylmethyl)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]propanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]propanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-[2-(tert-butoxycarbonylamino)thiazol-5-yl]propanoic acid CAS Name: 2-[(acetylthio)methyl]-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-thiazolyl]propanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]propanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-[2-(tert-butoxycarbonylamino)thiazol-5-yl]propionic acid Formula: C14H20N2O5S2 MolecularWeight: 360.449

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CN=C(S1)NC(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC(=O)SCC(CC1=CN=C(S1)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C14H20N2O5S2/c1-8(17)22-7-9(11(18)19)5-10-6-15-12(23-10)16-13(20)21-14(2,3)4/h6,9H,5,7H2,1-4H3,(H,18,19)(H,15,16,20)