5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]heptanethioic S-acid

Systemtic Name: 5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]heptanethioic S-acid Openeye Name: 6-(tert-butoxycarbonylamino)-5-methyl-heptanethioic S-acid CAS Name: 5-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptanethioic S-acid IUPAC Name: 5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]heptanethioic S-acid Traditional Name: 6-(tert-butoxycarbonylamino)-5-methyl-thioenanthic acid Formula: C13H25NO3S MolecularWeight: 275.4075

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(=O)S)C(C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(CCCC(=O)S)C(C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H25NO3S/c1-9(7-6-8-11(15)18)10(2)14-12(16)17-13(3,4)5/h9-10H,6-8H2,1-5H3,(H,14,16)(H,15,18)