methyl (2S)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanethioyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-sulfanylidenepentyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanethioyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanethioyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C17H32N2O4S2 MolecularWeight: 392.57698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H32N2O4S2/c1-11(2)10-13(19-16(21)23-17(3,4)5)14(24)18-12(8-9-25-7)15(20)22-6/h11-13H,8-10H2,1-7H3,(H,18,24)(H,19,21)/t12-,13-/m0/s1