S-[1-[[(2S)-4-methyl-1-(methylamino)-1-oxidanylidene-pentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanylidene-propan-2-yl] ethanethioate

Systemtic Name: S-[1-[[(2S)-4-methyl-1-(methylamino)-1-oxidanylidene-pentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanylidene-propan-2-yl] ethanethioate Openeye Name: S-[1-[(tert-butoxycarbonylamino)methyl]-2-[[(1S)-3-methyl-1-(methylcarbamoyl)butyl]amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[1-[[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]amino]-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: S-[1-[[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxopropan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-[(tert-butoxycarbonylamino)methyl]-2-keto-2-[[(1S)-3-methyl-1-(methylcarbamoyl)butyl]amino]ethyl] ester Formula: C17H31N3O5S MolecularWeight: 389.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC)NC(=O)C(CNC(=O)OC(C)(C)C)SC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC)NC(=O)C(CNC(=O)OC(C)(C)C)SC(=O)C

InChI

InChI=1S/C17H31N3O5S/c1-10(2)8-12(14(22)18-7)20-15(23)13(26-11(3)21)9-19-16(24)25-17(4,5)6/h10,12-13H,8-9H2,1-7H3,(H,18,22)(H,19,24)(H,20,23)/t12-,13?/m0/s1