Vitas-M small molecule compound
(2Z)-2-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STK760751
SMILES COc1ccc(cc1c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2)[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 C20H13NO5S MW 379.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13NO5S/c1-25-16-8-6-12(21(23)24)10-15(16)17-9-7-13(26-17)11-19-20(22)14-4-2-3-5-18(14)27-19/h2-11H,1H3/b19-11-InChIKey
CJNARFWTZFZHOB-ODLFYWEKSA-NSynonyms
(2Z)2((5(2methoxy5nitrophenyl)furan2yl)methylidene)1benzothiophen3(2H)one
(2Z)2((5(2METHOXY5NITROPHENYL)FURAN2YL)METHYLIDENE)1BENZOTHIOPHEN3ONE
2(5(2METHOXY5NITROPHENYL)FURAN2YLMETHYLENE)BENZO(B)THIOPHEN3ONE
COC1=C(C=C(C=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)C4=CC=CC=C4S3
COc1ccc(cc1c1ccc(o1)C=C1Sc2c(C1=O)cccc2)(N+)(=O)(O)
InChI=1SC20H13NO5Sc125168612(21(23)24)1015(16)179713(2617)111920(22)14423518(14)2719h211H1H3b1911
MFCD01066222
ZINC000012371418
ZINC12371418
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