tert-butyl 4-[4-[[(2S)-1-[[(2S)-3-(2-azanyl-1,3-thiazol-4-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]sulfamoyl]piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 4-[4-[[(2S)-1-[[(2S)-3-(2-azanyl-1,3-thiazol-4-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]sulfamoyl]piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-[4-[[(1S)-2-[[(1S)-1-[(2-aminothiazol-4-yl)methyl]-2-methoxy-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]sulfamoyl]piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[[(2S)-1-[[(2S)-3-(2-amino-4-thiazolyl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]sulfamoyl]-1-piperazinyl]-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[(2S)-1-[[(2S)-3-(2-amino-1,3-thiazol-4-yl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]sulfamoyl]piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-[[(1S)-2-[[(1S)-1-[(2-aminothiazol-4-yl)methyl]-2-keto-2-methoxy-ethyl]amino]-1-benzyl-2-keto-ethyl]sulfamoyl]piperazino]-4-keto-butyric acid tert-butyl ester Formula: C28H40N6O8S2 MolecularWeight: 652.7826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CSC(=N3)N)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CSC(=N3)N)C(=O)OC

InChI

InChI=1S/C28H40N6O8S2/c1-28(2,3)42-24(36)11-10-23(35)33-12-14-34(15-13-33)44(39,40)32-21(16-19-8-6-5-7-9-19)25(37)31-22(26(38)41-4)17-20-18-43-27(29)30-20/h5-9,18,21-22,32H,10-17H2,1-4H3,(H2,29,30)(H,31,37)/t21-,22-/m0/s1