Vitas-M small molecule compound
methyl 4-[({(2Z)-5-methyl-2-[(phenylsulfonyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}carbonyl)amino]butanoate
Catalog ID
STK636649
SMILES COC(=O)CCCNC(=O)c1[nH]/c(=N/S(=O)(=O)c2ccccc2)/sc1C
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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 C16H19N3O5S2 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O5S2/c1-11-14(15(21)17-10-6-9-13(20)24-2)18-16(25-11)19-26(22,23)12-7-4-3-5-8-12/h3-5,7-8H,6,9-10H2,1-2H3,(H,17,21)(H,18,19)InChIKey
IGXGVWGRGUJGCU-UHFFFAOYSA-NSynonyms
1010880-80-41010880804
CC1=C(N=C(S1)NS(=O)(=O)C2=CC=CC=C2)C(=O)NCCCC(=O)OC
COC(=O)CCCNC(=O)c1(nH)c(=NS(=O)(=O)c2ccccc2)sc1C
InChI=1SC16H19N3O5S2c11114(15(21)17106913(20)242)1816(2511)1926(2223)127435812h3578H6910H212H3(H1721)(H1819)
methyl4((((2Z)5methyl2((phenylsulfonyl)imino)23dihydro13thiazol4yl)carbonyl)amino)butanoate
methyl4((2(benzenesulfonamido)5methyl13thiazole4carbonyl)amino)butanoate
MFCD18161130
ZINC000012324112
ZINC12324112
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