Vitas-M small molecule compound
4-methyl-2-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenyl 4-bromobenzoate
Catalog ID
STK744602
SMILES Brc1ccc(cc1)C(=O)Oc1ccc(cc1/C=C/1\Sc2c(C1=O)cccc2)C
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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 C23H15BrO3S MW 451.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15BrO3S/c1-14-6-11-19(27-23(26)15-7-9-17(24)10-8-15)16(12-14)13-21-22(25)18-4-2-3-5-20(18)28-21/h2-13H,1H3/b21-13-InChIKey
KBFMLAGVTNKSDB-BKUYFWCQSA-NSynonyms
372495-89-1(4METHYL2((Z)(3OXO1BENZOTHIOPHEN2YLIDENE)METHYL)PHENYL)4BROMOBENZOATE
(Z)4methyl2((3oxobenzo(b)thiophen2(3H)ylidene)methyl)phenyl4bromobenzoate
372495891
4methyl2((Z)(3oxo1benzothiophen2(3H)ylidene)methyl)phenyl4bromobenzoate
Brc1ccc(cc1)C(=O)Oc1ccc(cc1C=C1Sc2c(C1=O)cccc2)C
CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)Br)C=C3C(=O)C4=CC=CC=C4S3
InChI=1SC23H15BrO3Sc11461119(2723(26)157917(24)10815)16(1214)132122(25)18423520(18)2821h213H1H3b2113
MFCD01942978
ZINC000013765359
ZINC13765359
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