Vitas-M small molecule compound

methyl 4-[({(2E)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}acetyl)amino]benzoate

Catalog ID
STK636065
SMILES COC(=O)c1ccc(cc1)NC(=O)Cc1cs/c(=N/S(=O)(=O)C)/[nH]1

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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 C14H15N3O5S2 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O5S2/c1-22-13(19)9-3-5-10(6-4-9)15-12(18)7-11-8-23-14(16-11)17-24(2,20)21/h3-6,8H,7H2,1-2H3,(H,15,18)(H,16,17)
InChIKey
XDALMJLLXAMPRV-UHFFFAOYSA-N
Synonyms
951965-01-8
951965018
COC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NS(=O)(=O)C
COC(=O)c1ccc(cc1)NC(=O)Cc1csc(=NS(=O)(=O)C)(nH)1
InChI=1SC14H15N3O5S2c12213(19)93510(649)1512(18)71182314(1611)1724(220)21h368H7H212H3(H1518)(H1617)
methyl4((((2E)2((methylsulfonyl)imino)23dihydro13thiazol4yl)acetyl)amino)benzoate
methyl4((2(2(methanesulfonamido)13thiazol4yl)acetyl)amino)benzoate
MFCD18160951
ZINC000013729888
ZINC13729888

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Available files

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