Vitas-M small molecule compound
(3Z)-5-bromo-3-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-hexyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814903
SMILES CCCCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)C2CCS(=O)(=O)C2)/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 C21H23BrN2O4S3 MW 543.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O4S3/c1-2-3-4-5-9-23-16-7-6-13(22)11-15(16)17(19(23)25)18-20(26)24(21(29)30-18)14-8-10-31(27,28)12-14/h6-7,11,14H,2-5,8-10,12H2,1H3/b18-17-InChIKey
UWJXMQBBKJBXKV-ZCXUNETKSA-NSynonyms
(3Z)5bromo3(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)1hexyl13dihydro2Hindol2one
(5Z)5(5BROMO1HEXYL2OXOINDOL3YLIDENE)3(11DIOXOTHIOLAN3YL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCN1C(=O)C(=C2SC(=S)N(C2=O)C2CCS(=O)(=O)C2)c2c1ccc(c2)Br
CCCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)C1=O
InChI=1SC21H23BrN2O4S3c12345923167613(22)1115(16)17(19(23)25)1820(26)24(21(29)3018)1481031(2728)1214h671114H2581012H21H3b1817
MFCD04442389
ZINC000100892997
ZINC000100892999
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