Vitas-M small molecule compound
{(5E)-5-[1-(3-methylbenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK336292
SMILES OC(=O)CN1C(=S)S/C(=C/2\c3ccccc3N(C2=O)Cc2cccc(c2)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 C21H16N2O4S2 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O4S2/c1-12-5-4-6-13(9-12)10-22-15-8-3-2-7-14(15)17(19(22)26)18-20(27)23(11-16(24)25)21(28)29-18/h2-9H,10-11H2,1H3,(H,24,25)/b18-17+InChIKey
HFASOFLCCCGVFD-ISLYRVAYSA-NSynonyms
((5E)5(1(3METHYLBENZYL)2OXO12DIHYDRO3HINDOL3YLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5(1((3methylphenyl)methyl)2oxoindol3ylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
CC1=CC(=CC=C1)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CC(=O)O)C2=O
InChI=1SC21H16N2O4S2c11254613(912)102215832714(15)17(19(22)26)1820(27)23(1116(24)25)21(28)2918h29H1011H21H3(H2425)b1817+
MFCD05815920
OC(=O)CN1C(=S)SC(=C2c3ccccc3N(C2=O)Cc2cccc(c2)C)C1=O
ZINC000009234551
ZINC9234551
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