Vitas-M small molecule compound
{(3Z)-3-[2-(4-methoxyphenyl)-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
STK813143
SMILES COc1ccc(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 C21H14N4O5S MW 434.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N4O5S/c1-30-12-8-6-11(7-9-12)18-22-21-25(23-18)20(29)17(31-21)16-13-4-2-3-5-14(13)24(19(16)28)10-15(26)27/h2-9H,10H2,1H3,(H,26,27)/b17-16-InChIKey
UUGTXURTVYXFJU-MSUUIHNZSA-NSynonyms
((3Z)3(2(4methoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)2oxo23dihydro1Hindol1yl)aceticacid
2((3Z)3(2(4METHOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)2OXOINDOL1YL)ACETICACID
COC1=CC=C(C=C1)C2=NN3C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)SC3=N2
COc1ccc(cc1)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)CC(=O)O)c2=O
InChI=1SC21H14N4O5Sc130128611(7912)18222125(2318)20(29)17(3121)1613423514(13)24(19(16)28)1015(26)27h29H10H21H3(H2627)b1716
MFCD03533771
ZINC000016805237
ZINC16805237
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