Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl propanoate
Catalog ID
STK138380
SMILES CCC(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)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 C17H16N2O4S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4S/c1-3-16(20)23-13-10-8-12(9-11-13)19(2)17-14-6-4-5-7-15(14)24(21,22)18-17/h4-11H,3H2,1-2H3InChIKey
XEJLGOPQNHBUPP-UHFFFAOYSA-NSynonyms
(4((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)PHENYL)PROPANOATE
4((11DIOXIDO12BENZOTHIAZOL3YL)(METHYL)AMINO)PHENYLPROPANOATE
CCC(=O)OC1=CC=C(C=C1)N(C)C2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC17H16N2O4Sc1316(20)231310812(91113)19(2)1714645715(14)24(2122)1817h411H3H212H3
MFCD01579562
ZINC000000082799
ZINC00082799
ZINC82799
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