Vitas-M small molecule compound

{(3Z)-3-[2-(4-butoxyphenyl)-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
STK703704
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\1/c3ccccc3N(C1=O)CC(=O)O)/c2=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 C24H20N4O5S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O5S/c1-2-3-12-33-15-10-8-14(9-11-15)21-25-24-28(26-21)23(32)20(34-24)19-16-6-4-5-7-17(16)27(22(19)31)13-18(29)30/h4-11H,2-3,12-13H2,1H3,(H,29,30)/b20-19-
InChIKey
FCEKBZAQRZAOJX-VXPUYCOJSA-N
Synonyms

((3Z)3(2(4butoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)2oxo23dihydro1Hindol1yl)aceticacid
(Z)2(3(2(4butoxyphenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)2oxoindolin1yl)aceticacid
2((3Z)3(2(4BUTOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)2OXOINDOL1YL)ACETICACID
2(3(2(4BUTOXYPHENYL)6OXOTHIAZOLO(32B)(124)TRIAZOL5(6H)YLIDENE)2OXOINDOLIN1YL)ACETICACID
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)CC(=O)O)c2=O
InChI=1SC24H20N4O5Sc12312331510814(91115)21252428(2621)23(32)20(3424)1916645717(16)27(22(19)31)1318(29)30h411H231213H21H3(H2930)b2019
MFCD03533858
ZINC000002261069
ZINC2261069

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Available files

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