Vitas-M small molecule compound
2-[(E)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenyl 4-methoxybenzoate
Catalog ID
STL000129
SMILES COc1ccc(cc1)C(=O)Oc1ccccc1/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 C23H16O4S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16O4S/c1-26-17-12-10-15(11-13-17)23(25)27-19-8-4-2-6-16(19)14-21-22(24)18-7-3-5-9-20(18)28-21/h2-14H,1H3/b21-14+InChIKey
LTIGNQYGYHLMAC-KGENOOAVSA-NSynonyms
634593-57-0(2((E)(3OXO1BENZOTHIOPHEN2YLIDENE)METHYL)PHENYL)4METHOXYBENZOATE
(E)2((3oxobenzo(b)thiophen2(3H)ylidene)methyl)phenyl4methoxybenzoate
2((E)(3oxo1benzothiophen2(3H)ylidene)methyl)phenyl4methoxybenzoate
634593570
COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=C3C(=O)C4=CC=CC=C4S3
COc1ccc(cc1)C(=O)Oc1ccccc1C=C1Sc2c(C1=O)cccc2
InChI=1SC23H16O4Sc12617121015(111317)23(25)2719842616(19)142122(24)18735920(18)2821h214H1H3b2114+
MFCD03689224
ZINC000005065844
ZINC05065844
ZINC5065844
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