Vitas-M small molecule compound
2-[(5Z)-5-(5-bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid
Catalog ID
STK814561
SMILES CCCCN1C(=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 C17H17BrN2O5S3 MW 505.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN2O5S3/c1-2-3-6-19-12-5-4-10(18)9-11(12)13(15(19)21)14-16(22)20(17(26)27-14)7-8-28(23,24)25/h4-5,9H,2-3,6-8H2,1H3,(H,23,24,25)/b14-13-InChIKey
ISNWBAISYPUDME-YPKPFQOOSA-NSynonyms
618076-91-82((5Z)5(5bromo1butyl2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)ethanesulfonicacid
2((5Z)5(5BROMO1BUTYL2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ETHANESULFONICACID
2(5(5BROMO1BUTYL2OXOINDOLIN3YLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)ETHANESULFONICACID
618076918
CCCCN1C(=O)C(=C2SC(=S)N(C2=O)CCS(=O)(=O)O)c2c1ccc(c2)Br
CCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O)C1=O
InChI=1SC17H17BrN2O5S3c123619125410(18)911(12)13(15(19)21)1416(22)20(17(26)2714)7828(2324)25h459H2368H21H3(H232425)b1413
MFCD05154798
ZINC000016731530
ZINC16731530
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