Vitas-M small molecule compound
(2E)-2-cyano-N-methyl-3-[5-(4-methyl-3-nitrophenyl)furan-2-yl]prop-2-enamide
Catalog ID
STK762120
SMILES CNC(=O)/C(=C/c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])C)/C#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 C16H13N3O4 MW 311.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4/c1-10-3-4-11(8-14(10)19(21)22)15-6-5-13(23-15)7-12(9-17)16(20)18-2/h3-8H,1-2H3,(H,18,20)/b12-7+InChIKey
LFNOZCYLHFNRJZ-KPKJPENVSA-NSynonyms
(2E)2cyanoNmethyl3(5(4methyl3nitrophenyl)furan2yl)prop2enamide
(E)2CYANONMETHYL3(5(4METHYL3NITROPHENYL)FURAN2YL)PROP2ENAMIDE
2CYANONMETHYL3(5(4METHYL3NITROPHENYL)FURAN2YL)ACRYLAMIDE
CC1=C(C=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC)(N+)(=O)(O)
CNC(=O)C(=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))C)C#N
InChI=1SC16H13N3O4c1103411(814(10)19(21)22)156513(2315)712(917)16(20)182h38H12H3(H1820)b127+
MFCD01872656
ZINC000000083679
ZINC00083679
ZINC83679
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