Vitas-M small molecule compound

(3Z)-3-[2-(3-chlorophenyl)-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
STK514522
SMILES C=CCN1C(=O)/C(=c/2\sc3n(c2=O)nc(n3)c2cccc(c2)Cl)/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 C21H13ClN4O2S MW 420.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN4O2S/c1-2-10-25-15-9-4-3-8-14(15)16(19(25)27)17-20(28)26-21(29-17)23-18(24-26)12-6-5-7-13(22)11-12/h2-9,11H,1,10H2/b17-16-
InChIKey
QODIMJRVZZZKIF-MSUUIHNZSA-N
Synonyms
578744-17-9
(3Z)3(2(3chlorophenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1(prop2en1yl)13dihydro2Hindol2one
(5Z)2(3chlorophenyl)5(2oxo1prop2enylindol3ylidene)(13)thiazolo(32b)(124)triazol6one
(Z)5(1allyl2oxoindolin3ylidene)2(3chlorophenyl)thiazolo(32b)(124)triazol6(5H)one
1ALLYL3(2(3CHLOROPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5(6H)YLIDENE)13DIHYDRO2HINDOL2ONE
578744179
C=CCN1C(=O)C(=c2sc3n(c2=O)nc(n3)c2cccc(c2)Cl)c2c1cccc2
C=CCN1C2=CC=CC=C2C(=C3C(=O)N4C(=NC(=N4)C5=CC(=CC=C5)Cl)S3)C1=O
InChI=1SC21H13ClN4O2Sc12102515943814(15)16(19(25)27)1720(28)2621(2917)2318(2426)1265713(22)1112h2911H110H2b1716
MFCD04024020
ZINC000003637465
ZINC03637465
ZINC3637465

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.