Vitas-M small molecule compound
(2Z)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[1-(4-methoxy-2-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK182732
SMILES N#C/C(=C/c1cc(n(c1C)c1ccc(cc1[N+](=O)[O-])OC)C)/C(=O)Nc1cc(Cl)ccc1C
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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 C24H21ClN4O4 MW 464.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN4O4/c1-14-5-6-19(25)11-21(14)27-24(30)18(13-26)10-17-9-15(2)28(16(17)3)22-8-7-20(33-4)12-23(22)29(31)32/h5-12H,1-4H3,(H,27,30)/b18-10-InChIKey
IYDFTRGVQGIENU-ZDLGFXPLSA-NSynonyms
(2Z)N(5CHLORO2METHYLPHENYL)2CYANO3(1(4METHOXY2NITROPHENYL)25DIMETHYL1HPYRROL3YL)PROP2ENAMIDE
(Z)N(5CHLORO2METHYLPHENYL)2CYANO3(1(4METHOXY2NITROPHENYL)25DIMETHYLPYRROL3YL)PROP2ENAMIDE
CC1=C(C=C(C=C1)Cl)NC(=O)C(=CC2=C(N(C(=C2)C)C3=C(C=C(C=C3)OC)(N+)(=O)(O))C)C#N
InChI=1SC24H21ClN4O4c1145619(25)1121(14)2724(30)18(1326)1017915(2)28(16(17)3)228720(334)1223(22)29(31)32h512H14H3(H2730)b1810
MFCD03649429
N#CC(=Cc1cc(n(c1C)c1ccc(cc1(N+)(=O)(O))OC)C)C(=O)Nc1cc(Cl)ccc1C
ZINC000012342191
ZINC12342191
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