tert-butyl 2-[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]sulfanylethanoate Openeye Name: tert-butyl 2-[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanethioyl]sulfanylacetate CAS Name: 2-[[(2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-sulfanylidenepentyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]sulfanylacetate Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanethioyl]thio]acetic acid tert-butyl ester Formula: C17H31NO4S2 MolecularWeight: 377.56234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=S)SCC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H31NO4S2/c1-11(2)9-12(18-15(20)22-17(6,7)8)14(23)24-10-13(19)21-16(3,4)5/h11-12H,9-10H2,1-8H3,(H,18,20)/t12-/m0/s1