Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-6-[(4-nitrobenzyl)oxy]-1-benzofuran-3(2H)-one
Catalog ID
STK921605
SMILES O=C1/C(=C/c2sccc2C)/Oc2c1ccc(c2)OCc1ccc(cc1)[N+](=O)[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 C21H15NO5S MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO5S/c1-13-8-9-28-20(13)11-19-21(23)17-7-6-16(10-18(17)27-19)26-12-14-2-4-15(5-3-14)22(24)25/h2-11H,12H2,1H3/b19-11-InChIKey
LNCNNTMCZHVRFT-ODLFYWEKSA-NSynonyms
622803-29-6(2Z)2((3methylthiophen2yl)methylidene)6((4nitrobenzyl)oxy)1benzofuran3(2H)one
(2Z)2((3METHYLTHIOPHEN2YL)METHYLIDENE)6((4NITROPHENYL)METHOXY)1BENZOFURAN3ONE
(Z)2((3methylthiophen2yl)methylene)6((4nitrobenzyl)oxy)benzofuran3(2H)one
2((3METHYL(2THIENYL))METHYLENE)6((4NITROPHENYL)METHOXY)BENZO(B)FURAN3ONE
622803296
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H15NO5Sc113892820(13)111921(23)177616(1018(17)2719)2612142415(5314)22(24)25h211H12H21H3b1911
MFCD04158187
O=C1C(=Cc2sccc2C)Oc2c1ccc(c2)OCc1ccc(cc1)(N+)(=O)(O)
ZINC000013758663
ZINC13758663
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