bis(phenylmethyl) (5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-2-sulfanylidene-hexanedioate

Systemtic Name: bis(phenylmethyl) (5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-2-sulfanylidene-hexanedioate Openeye Name: dibenzyl (5S)-5-(tert-butoxycarbonylamino)-3-oxo-2-thioxo-hexanedioate CAS Name: (5S)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-2-sulfanylidenehexanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-2-sulfanylidenehexanedioate Traditional Name: (5S)-5-(tert-butoxycarbonylamino)-3-keto-2-thioxo-adipic acid dibenzyl ester Formula: C25H27NO7S MolecularWeight: 485.54938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)C(=S)C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)C(=S)C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H27NO7S/c1-25(2,3)33-24(30)26-19(22(28)31-15-17-10-6-4-7-11-17)14-20(27)21(34)23(29)32-16-18-12-8-5-9-13-18/h4-13,19H,14-16H2,1-3H3,(H,26,30)/t19-/m0/s1