Vitas-M small molecule compound

tert-butyl {(2S)-1-[(4-chloro-1,1-dioxidotetrahydrothiophen-3-yl)amino]-1-oxopropan-2-yl}carbamate

Catalog ID
STK615032
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)NC1CS(=O)(=O)CC1Cl)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H21ClN2O5S MW 340.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H21ClN2O5S/c1-7(14-11(17)20-12(2,3)4)10(16)15-9-6-21(18,19)5-8(9)13/h7-9H,5-6H2,1-4H3,(H,14,17)(H,15,16)/t7-,8?,9?/m0/s1
InChIKey
HEZKANAEKSLIES-UEJVZZJDSA-N
Synonyms
1013751-78-4
1013751784
CC(C(=O)NC1CS(=O)(=O)CC1Cl)NC(=O)OC(C)(C)C
InChI=1SC12H21ClN2O5Sc17(1411(17)2012(23)4)10(16)159621(1819)58(9)13h79H56H214H3(H1417)(H1516)t78?9?m0s1
MFCD10488727
O=C(OC(C)(C)C)N(C@H)(C(=O)NC1CS(=O)(=O)CC1Cl)C
tertbutyl((2S)1((4chloro11dioxidotetrahydrothiophen3yl)amino)1oxopropan2yl)carbamate
tertbutylN((2S)1((4chloro11dioxothiolan3yl)amino)1oxopropan2yl)carbamate
ZINC000009305242
ZINC000009305245

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.