Vitas-M small molecule compound
(2Z)-2-cyano-3-[4-(2,4-dinitrophenoxy)-3-iodo-5-methoxyphenyl]-N-(4-ethylphenyl)prop-2-enamide
Catalog ID
STK181015
SMILES CCc1ccc(cc1)NC(=O)/C(=C\c1cc(I)c(c(c1)OC)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/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 C25H19IN4O7 MW 614.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19IN4O7/c1-3-15-4-6-18(7-5-15)28-25(31)17(14-27)10-16-11-20(26)24(23(12-16)36-2)37-22-9-8-19(29(32)33)13-21(22)30(34)35/h4-13H,3H2,1-2H3,(H,28,31)/b17-10-InChIKey
JJUKWKUTUKCLTG-YVLHZVERSA-NSynonyms
(2Z)2CYANO3(4(24DINITROPHENOXY)3IODO5METHOXYPHENYL)N(4ETHYLPHENYL)PROP2ENAMIDE
(Z)2cyano3(4(24dinitrophenoxy)3iodo5methoxyphenyl)N(4ethylphenyl)prop2enamide
CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)I)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))OC)C#N
CCc1ccc(cc1)NC(=O)C(=Cc1cc(I)c(c(c1)OC)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C#N
InChI=1SC25H19IN4O7c13154618(7515)2825(31)17(1427)10161120(26)24(23(1216)362)37229819(29(32)33)1321(22)30(34)35h413H3H212H3(H2831)b1710
MFCD02756132
ZINC000100206977
ZINC100206977
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