Vitas-M small molecule compound
(2Z)-2-{3-[(4-nitrobenzyl)oxy]benzylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STL368461
SMILES [O-][N+](=O)c1ccc(cc1)COc1cccc(c1)/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 C22H15NO4S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15NO4S/c24-22-19-6-1-2-7-20(19)28-21(22)13-16-4-3-5-18(12-16)27-14-15-8-10-17(11-9-15)23(25)26/h1-13H,14H2/b21-13-InChIKey
YDHLFBGXDIWFJT-BKUYFWCQSA-NSynonyms
(2Z)2((3((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(3((4nitrobenzyl)oxy)benzylidene)1benzothiophen3(2H)one
(O)(N+)(=O)c1ccc(cc1)COc1cccc(c1)C=C1Sc2c(C1=O)cccc2
C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC=C3)OCC4=CC=C(C=C4)(N+)(=O)(O))S2
InChI=1SC22H15NO4Sc242219612720(19)2821(22)131643518(1216)27141581017(11915)23(25)26h113H14H2b2113
MFCD01045740
ZINC000001198531
ZINC01198531
ZINC1198531
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