tert-butyl (2S)-6-(carbamothioylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Systemtic Name: tert-butyl (2S)-6-(carbamothioylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Openeye Name: tert-butyl (2S)-2-(tert-butoxycarbonylamino)-6-(carbamothioylamino)hexanoate CAS Name: (2S)-6-(carbamothioylamino)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-6-(carbamothioylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-6-thioureido-hexanoic acid tert-butyl ester Formula: C16H31N3O4S MolecularWeight: 361.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCNC(=S)N)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H31N3O4S/c1-15(2,3)22-12(20)11(9-7-8-10-18-13(17)24)19-14(21)23-16(4,5)6/h11H,7-10H2,1-6H3,(H,19,21)(H3,17,18,24)/t11-/m0/s1