Vitas-M small molecule compound

5-(4,6-dibromo-7-methoxy-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-thiophen-3-ylmethylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide

Catalog ID
STK692568
SMILES COc1c(Br)c(C2ON=C(C2C)C(=O)N/N=C/c2cscc2)c(c2c1OCO2)Br

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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 C18H15Br2N3O5S MW 545.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Br2N3O5S/c1-8-13(18(24)22-21-5-9-3-4-29-6-9)23-28-14(8)10-11(19)15(25-2)17-16(12(10)20)26-7-27-17/h3-6,8,14H,7H2,1-2H3,(H,22,24)/b21-5+
InChIKey
FBSXKBSCYBAPCX-IGCPIRJNSA-N
Synonyms

5(46dibromo7methoxy13benzodioxol5yl)4methylN((E)thiophen3ylmethylidene)45dihydro12oxazole3carbohydrazide
5(46dibromo7methoxy13benzodioxol5yl)4methylN((E)thiophen3ylmethylideneamino)45dihydro12oxazole3carboxamide
CC1C(ON=C1C(=O)NN=CC2=CSC=C2)C3=C(C4=C(C(=C3Br)OC)OCO4)Br
COc1c(Br)c(C2ON=C(C2C)C(=O)NN=Cc2cscc2)c(c2c1OCO2)Br
InChI=1SC18H15Br2N3O5Sc1813(18(24)222159342969)232814(8)1011(19)15(252)1716(12(10)20)2672717h36814H7H212H3(H2224)b215+
MFCD10038580
ZINC000100237835
ZINC000100237847

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Available files

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