Vitas-M small molecule compound
3-{(5Z)-5-[5-bromo-1-(carboxymethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK702507
SMILES OC(=O)CCN1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)CC(=O)O)/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 C16H11BrN2O6S2 MW 471.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN2O6S2/c17-7-1-2-9-8(5-7)12(14(24)19(9)6-11(22)23)13-15(25)18(16(26)27-13)4-3-10(20)21/h1-2,5H,3-4,6H2,(H,20,21)(H,22,23)/b13-12-InChIKey
QLNAFZJJJCEUPG-SEYXRHQNSA-NSynonyms
383371-22-0(Z)3(5(5bromo1(carboxymethyl)2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5(5bromo1(carboxymethyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5(5BROMO1(CARBOXYMETHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
383371220
C1=CC2=C(C=C1Br)C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C(=O)N2CC(=O)O
InChI=1SC16H11BrN2O6S2c1771298(57)12(14(24)19(9)611(22)23)1315(25)18(16(26)2713)4310(20)21h125H346H2(H2021)(H2223)b1312
MFCD02998958
OC(=O)CCN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)CC(=O)O)C1=O
ZINC000001782603
ZINC1782603
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