Vitas-M small molecule compound
5-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
Catalog ID
STK134662
SMILES COc1ccc(cc1OC(=O)C)/C=N/NC1=NS(=O)(=O)c2c1cccc2
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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 C17H15N3O5S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5S/c1-11(21)25-15-9-12(7-8-14(15)24-2)10-18-19-17-13-5-3-4-6-16(13)26(22,23)20-17/h3-10H,1-2H3,(H,19,20)/b18-10+InChIKey
CQJZDEZUGMSWGG-VCHYOVAHSA-NSynonyms
(5((E)((11dioxo12benzothiazol3yl)hydrazinylidene)methyl)2methoxyphenyl)acetate
5((E)((11DIOXIDO12BENZISOTHIAZOL3YL)HYDRAZONO)METHYL)2METHOXYPHENYLACETATE
5((E)(2(11DIOXIDO12BENZOTHIAZOL3YL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYLACETATE
CC(=O)OC1=C(C=CC(=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)OC
COc1ccc(cc1OC(=O)C)C=NNC1=NS(=O)(=O)c2c1cccc2
InChI=1SC17H15N3O5Sc111(21)2515912(7814(15)242)1018191713534616(13)26(2223)2017h310H12H3(H1920)b1810+
MFCD03214997
ZINC000004680964
ZINC35227303
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