Vitas-M small molecule compound
{(3Z)-5-bromo-2-oxo-3-[4-oxo-3-(2-sulfoethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid
Catalog ID
STK702848
SMILES OC(=O)CN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCS(=O)(=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 C15H11BrN2O7S3 MW 507.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN2O7S3/c16-7-1-2-9-8(5-7)11(13(21)18(9)6-10(19)20)12-14(22)17(15(26)27-12)3-4-28(23,24)25/h1-2,5H,3-4,6H2,(H,19,20)(H,23,24,25)/b12-11-InChIKey
VGQIVMGOIPMHDZ-QXMHVHEDSA-NSynonyms
((3Z)5bromo2oxo3(4oxo3(2sulfoethyl)2thioxo13thiazolidin5ylidene)23dihydro1Hindol1yl)aceticacid
(Z)2(5bromo2oxo3(4oxo3(2sulfoethyl)2thioxothiazolidin5ylidene)indolin1yl)aceticacid
2((3Z)5BROMO2OXO3(4OXO2SULFANYLIDENE3(2SULFOETHYL)13THIAZOLIDIN5YLIDENE)INDOL1YL)ACETICACID
C1=CC2=C(C=C1Br)C(=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O)C(=O)N2CC(=O)O
InChI=1SC15H11BrN2O7S3c1671298(57)11(13(21)18(9)610(19)20)1214(22)17(15(26)2712)3428(2324)25h125H346H2(H1920)(H232425)b1211
MFCD02992316
OC(=O)CN1C(=O)C(=C2SC(=S)N(C2=O)CCS(=O)(=O)O)c2c1ccc(c2)Br
ZINC000013801739
ZINC13801739
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