Vitas-M small molecule compound
(2E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enethioamide
Catalog ID
STK863005
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1[N+](=O)[O-])OC)/C(=S)N
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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 C15H11N3O4S MW 329.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O4S/c1-21-10-2-4-12(13(7-10)18(19)20)14-5-3-11(22-14)6-9(8-16)15(17)23/h2-7H,1H3,(H2,17,23)/b9-6+InChIKey
JLHKKLABNXVPQU-RMKNXTFCSA-NSynonyms
833441-78-4(2E)2(AMINOTHIOXOMETHYL)3(5(4METHOXY2NITROPHENYL)(2FURYL))PROP2ENENITRILE
(2E)2cyano3(5(4methoxy2nitrophenyl)furan2yl)prop2enethioamide
(E)2CYANO3(5(4METHOXY2NITROPHENYL)FURAN2YL)PROP2ENETHIOAMIDE
833441784
COC1=CC(=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=S)N)(N+)(=O)(O)
InChI=1SC15H11N3O4Sc121102412(13(710)18(19)20)145311(2214)69(816)15(17)23h27H1H3(H21723)b96+
MFCD06629921
N#CC(=Cc1ccc(o1)c1ccc(cc1(N+)(=O)(O))OC)C(=S)N
ZINC000002884323
ZINC02884323
ZINC2884323
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