Vitas-M small molecule compound

N-[4-(acetylamino)phenyl]-N~2~-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-L-alaninamide

Catalog ID
STK651135
SMILES O=C(N[C@H](C(=O)Nc1ccc(cc1)NC(=O)C)C)NC1CCS(=O)(=O)C1

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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 C16H22N4O5S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O5S/c1-10(17-16(23)20-14-7-8-26(24,25)9-14)15(22)19-13-5-3-12(4-6-13)18-11(2)21/h3-6,10,14H,7-9H2,1-2H3,(H,18,21)(H,19,22)(H2,17,20,23)/t10-,14?/m0/s1
InChIKey
ZJHWVOXFBIUUAV-XLLULAGJSA-N
Synonyms
1212436-10-6
(2S)N(4acetamidophenyl)2((11dioxothiolan3yl)carbamoylamino)propanamide
(2S)N(4acetamidophenyl)2(3(11dioxidotetrahydrothiophen3yl)ureido)propanamide
1212436106
CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)NC(=O)NC2CCS(=O)(=O)C2
InChI=1SC16H22N4O5Sc110(1716(23)20147826(2425)914)15(22)19135312(4613)1811(2)21h361014H79H212H3(H1821)(H1922)(H2172023)t1014?m0s1
MFCD18165855
N(4(acetylamino)phenyl)N~2~((11dioxidotetrahydrothiophen3yl)carbamoyl)Lalaninamide
N(4(ACETYLAMINO)PHENYL)N2((11DIOXIDOTETRAHYDROTHIOPHEN3YL)CARBAMOYL)LALANINAMIDE
O=C(N(C@H)(C(=O)Nc1ccc(cc1)NC(=O)C)C)NC1CCS(=O)(=O)C1
ZINC000036366158
ZINC000036366160

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Available files

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