Vitas-M small molecule compound
(5Z)-5-[(5-bromo-3-chloro-1-benzofuran-2-yl)methylidene]-3-(3-methoxypropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK883217
SMILES COCCCN1C(=S)S/C(=C\c2oc3c(c2Cl)cc(cc3)Br)/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 C16H13BrClNO3S2 MW 446.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrClNO3S2/c1-21-6-2-5-19-15(20)13(24-16(19)23)8-12-14(18)10-7-9(17)3-4-11(10)22-12/h3-4,7-8H,2,5-6H2,1H3/b13-8-InChIKey
BDQYKPZZFFOTDW-JYRVWZFOSA-NSynonyms
(5Z)5((5bromo3chloro1benzofuran2yl)methylidene)3(3methoxypropyl)2sulfanylidene13thiazolidin4one
(5Z)5((5bromo3chloro1benzofuran2yl)methylidene)3(3methoxypropyl)2thioxo13thiazolidin4one
COCCCN1C(=O)C(=CC2=C(C3=C(O2)C=CC(=C3)Br)Cl)SC1=S
COCCCN1C(=S)SC(=Cc2oc3c(c2Cl)cc(cc3)Br)C1=O
InChI=1SC16H13BrClNO3S2c1216251915(20)13(2416(19)23)81214(18)1079(17)3411(10)2212h3478H256H21H3b138
MFCD06646733
ZINC000016750551
ZINC16750551
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