Vitas-M small molecule compound
3-[(5Z)-5-(5-bromo-1-hexyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK816256
SMILES CCCCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCC(=O)O)/c2c1ccc(c2)Br
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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 C20H21BrN2O4S2 MW 497.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O4S2/c1-2-3-4-5-9-22-14-7-6-12(21)11-13(14)16(18(22)26)17-19(27)23(20(28)29-17)10-8-15(24)25/h6-7,11H,2-5,8-10H2,1H3,(H,24,25)/b17-16-InChIKey
HRBBWJLUABYFCD-MSUUIHNZSA-NSynonyms
867136-56-93((5Z)5(5bromo1hexyl2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5(5BROMO1HEXYL2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
867136569
CCCCCCN1C(=O)C(=C2SC(=S)N(C2=O)CCC(=O)O)c2c1ccc(c2)Br
CCCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C1=O
InChI=1SC20H21BrN2O4S2c12345922147612(21)1113(14)16(18(22)26)1719(27)23(20(28)2917)10815(24)25h6711H25810H21H3(H2425)b1716
MFCD04446026
ZINC000002701142
ZINC2701142
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