S-ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]pentanethioate

Systemtic Name: S-ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]pentanethioate Openeye Name: S-ethyl (2S)-5-[benzyloxycarbonyl(tert-butoxycarbonyl)amino]-2-(tert-butoxycarbonylamino)pentanethioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]-phenylmethoxycarbonylamino]pentanethioic acid S-ethyl ester IUPAC Name: S-ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonylamino]pentanethioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-[tert-butoxycarbonyl(carbobenzoxy)amino]pentanethioic acid S-ethyl ester Formula: C25H38N2O7S MolecularWeight: 510.64342

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(CCCN(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCSC(=O)[C@H](CCCN(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H38N2O7S/c1-8-35-20(28)19(26-21(29)33-24(2,3)4)15-12-16-27(23(31)34-25(5,6)7)22(30)32-17-18-13-10-9-11-14-18/h9-11,13-14,19H,8,12,15-17H2,1-7H3,(H,26,29)/t19-/m0/s1