Vitas-M small molecule compound
ethyl [(3Z)-3-[(2E)-benzylidenehydrazinylidene]-1,1-dioxido-1,2-benzothiazol-2(3H)-yl]acetate
Catalog ID
STL287047
SMILES CCOC(=O)CN1/C(=N\N=C\c2ccccc2)/c2c(S1(=O)=O)cccc2
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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 C18H17N3O4S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O4S/c1-2-25-17(22)13-21-18(20-19-12-14-8-4-3-5-9-14)15-10-6-7-11-16(15)26(21,23)24/h3-12H,2,13H2,1H3/b19-12+,20-18-InChIKey
NXZHIRLYQNQDHI-UCNDJUHZSA-NSynonyms
CCOC(=O)CN1C(=NN=CC2=CC=CC=C2)C3=CC=CC=C3S1(=O)=O
CCOC(=O)CN1C(=NN=Cc2ccccc2)c2c(S1(=O)=O)cccc2
ethyl((3Z)3((2E)benzylidenehydrazinylidene)11dioxido12benzothiazol2(3H)yl)acetate
ethyl2((3Z)3((E)benzylidenehydrazinylidene)11dioxo12benzothiazol2yl)acetate
InChI=1SC18H17N3O4Sc122517(22)132118(201912148435914)1510671116(15)26(2123)24h312H213H21H3b1912+2018
MFCD24847376
ZINC000095481770
ZINC101349167
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