Vitas-M small molecule compound

(3Z)-5-bromo-3-[2-(3-methylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one

Catalog ID
STK817377
SMILES C=CCN1C(=O)/C(=c/2\sc3n(c2=O)nc(n3)c2cccc(c2)C)/c2c1ccc(c2)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 C22H15BrN4O2S MW 479.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrN4O2S/c1-3-9-26-16-8-7-14(23)11-15(16)17(20(26)28)18-21(29)27-22(30-18)24-19(25-27)13-6-4-5-12(2)10-13/h3-8,10-11H,1,9H2,2H3/b18-17-
InChIKey
PXMRYCAMQWPVGZ-ZCXUNETKSA-N
Synonyms
586987-71-5
(3Z)5bromo3(2(3methylphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1(prop2en1yl)13dihydro2Hindol2one
(5Z)5(5BROMO2OXO1PROP2ENYLINDOL3YLIDENE)2(3METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5(1allyl5bromo2oxoindolin3ylidene)2(mtolyl)thiazolo(32b)(124)triazol6(5H)one
5(5BROMO2OXO1PROP2ENYLBENZO(D)AZOLIN3YLIDENE)2(3METHYLPHENYL)13THIAZOLIDINO(32D)124TRIAZOL6ONE
586987715
C=CCN1C(=O)C(=c2sc3n(c2=O)nc(n3)c2cccc(c2)C)c2c1ccc(c2)Br
CC1=CC=CC(=C1)C2=NN3C(=O)C(=C4C5=C(C=CC(=C5)Br)N(C4=O)CC=C)SC3=N2
InChI=1SC22H15BrN4O2Sc13926168714(23)1115(16)17(20(26)28)1821(29)2722(3018)2419(2527)1364512(2)1013h381011H19H22H3b1817
MFCD04031992
ZINC000002395012
ZINC02395012
ZINC2395012

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Available files

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