Vitas-M small molecule compound
(2Z)-3-[1-(2-methoxy-4-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK201523
SMILES N#C/C(=C/c1cc(n(c1C)c1ccc(cc1OC)[N+](=O)[O-])C)/c1nc2c([nH]1)ccc(c2)C
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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 C24H21N5O3 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O3/c1-14-5-7-20-21(9-14)27-24(26-20)18(13-25)11-17-10-15(2)28(16(17)3)22-8-6-19(29(30)31)12-23(22)32-4/h5-12H,1-4H3,(H,26,27)/b18-11-InChIKey
XKZCXOOHCASHEN-WQRHYEAKSA-NSynonyms
(2Z)3(1(2METHOXY4NITROPHENYL)25DIMETHYL1HPYRROL3YL)2(5METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
(Z)3(1(2METHOXY4NITROPHENYL)25DIMETHYLPYRROL3YL)2(6METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(N(C(=C3)C)C4=C(C=C(C=C4)(N+)(=O)(O))OC)C)C#N
InChI=1SC24H21N5O3c114572021(914)2724(2620)18(1325)11171015(2)28(16(17)3)228619(29(30)31)1223(22)324h512H14H3(H2627)b1811
MFCD05997605
N#CC(=Cc1cc(n(c1C)c1ccc(cc1OC)(N+)(=O)(O))C)c1nc2c((nH)1)ccc(c2)C
ZINC000009934912
ZINC09934912
ZINC9934912
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