Vitas-M small molecule compound
butyl 2-chloro-5-{5-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STL431909
SMILES CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2
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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 C24H19ClO4S MW 438.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClO4S/c1-2-3-12-28-24(27)18-13-15(8-10-19(18)25)20-11-9-16(29-20)14-22-23(26)17-6-4-5-7-21(17)30-22/h4-11,13-14H,2-3,12H2,1H3/b22-14-InChIKey
HVYOIKYEKSBWKE-HMAPJEAMSA-NSynonyms
butyl2chloro5(5((Z)(3oxo1benzothiophen2(3H)ylidene)methyl)furan2yl)benzoate
BUTYL2CHLORO5(5((Z)(3OXO1BENZOTHIOPHEN2YLIDENE)METHYL)FURAN2YL)BENZOATE
CCCCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)C4=CC=CC=C4S3)Cl
CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1Sc2c(C1=O)cccc2
InChI=1SC24H19ClO4Sc123122824(27)181315(81019(18)25)2011916(2920)142223(26)17645721(17)3022h4111314H2312H21H3b2214
MFCD01158716
ZINC000013603149
ZINC13603149
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