Vitas-M small molecule compound

{(3Z)-3-[2-(4-tert-butylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid

Catalog ID
STK819231
SMILES OC(=O)CN1c2ccccc2/C(=c\2/sc3n(c2=O)nc(n3)c2ccc(cc2)C(C)(C)C)/C1=O

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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 C24H20N4O4S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O4S/c1-24(2,3)14-10-8-13(9-11-14)20-25-23-28(26-20)22(32)19(33-23)18-15-6-4-5-7-16(15)27(21(18)31)12-17(29)30/h4-11H,12H2,1-3H3,(H,29,30)/b19-18-
InChIKey
FXCNTIJBXWBTNI-HNENSFHCSA-N
Synonyms

((3Z)3(2(4tertbutylphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)2oxo23dihydro1Hindol1yl)aceticacid
2((3Z)3(2(4TERTBUTYLPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)2OXOINDOL1YL)ACETICACID
2(3(2(4TERTBUTYLPHENYL)6OXO5H6H(124)TRIAZOLO(32B)(13)THIAZOL5YLIDENE)2OXO23DIHYDRO1HINDOL1YL)ACETICACID
CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)SC3=N2
InChI=1SC24H20N4O4Sc124(23)1410813(91114)20252328(2620)22(32)19(3323)1815645716(15)27(21(18)31)1217(29)30h411H12H213H3(H2930)b1918
MFCD03533739
OC(=O)CN1c2ccccc2C(=c2sc3n(c2=O)nc(n3)c2ccc(cc2)C(C)(C)C)C1=O
ZINC000002704706
ZINC2704706

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Available files

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