Vitas-M small molecule compound
{(3Z)-3-[2-(3,4-dimethoxyphenyl)-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
STK819746
SMILES COc1cc(ccc1OC)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 C22H16N4O6S MW 464.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O6S/c1-31-14-8-7-11(9-15(14)32-2)19-23-22-26(24-19)21(30)18(33-22)17-12-5-3-4-6-13(12)25(20(17)29)10-16(27)28/h3-9H,10H2,1-2H3,(H,27,28)/b18-17-InChIKey
TWHUOUGFJKBRQL-ZCXUNETKSA-NSynonyms
618854-36-7((3Z)3(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)2oxo23dihydro1Hindol1yl)aceticacid
(Z)2(3(2(34dimethoxyphenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)2oxoindolin1yl)aceticacid
2((3Z)3(2(34DIMETHOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)2OXOINDOL1YL)ACETICACID
618854367
COC1=C(C=C(C=C1)C2=NN3C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)SC3=N2)OC
COc1cc(ccc1OC)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)CC(=O)O)c2=O
InChI=1SC22H16N4O6Sc131148711(915(14)322)19232226(2419)21(30)18(3322)1712534613(12)25(20(17)29)1016(27)28h39H10H212H3(H2728)b1817
MFCD04012675
ZINC000002409132
ZINC2409132
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