Vitas-M small molecule compound
2-chloro-5-[(2E)-2-(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)hydrazinyl]benzoic acid
Catalog ID
STL343988
SMILES N#CC1=C(C)/C(=N\Nc2ccc(c(c2)C(=O)O)Cl)/C(=O)N(C1=O)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 C15H11ClN4O4 MW 346.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClN4O4/c1-7-10(6-17)13(21)20(2)14(22)12(7)19-18-8-3-4-11(16)9(5-8)15(23)24/h3-5,18H,1-2H3,(H,23,24)/b19-12+InChIKey
CIMJNGVOHHIBEL-XDHOZWIPSA-NSynonyms
(E)2chloro5(2(5cyano14dimethyl26dioxo16dihydropyridin3(2H)ylidene)hydrazinyl)benzoicacid
2chloro5((2E)2(5cyano14dimethyl26dioxo16dihydropyridin3(2H)ylidene)hydrazinyl)benzoicacid
2CHLORO5((2E)2(5CYANO14DIMETHYL26DIOXOPYRIDIN3YLIDENE)HYDRAZINYL)BENZOICACID
CC1=C(C(=O)N(C(=O)C1=NNC2=CC(=C(C=C2)Cl)C(=O)O)C)C#N
InChI=1SC15H11ClN4O4c1710(617)13(21)20(2)14(22)12(7)191883411(16)9(58)15(23)24h3518H12H3(H2324)b1912+
MFCD04171987
N#CC1=C(C)C(=NNc2ccc(c(c2)C(=O)O)Cl)C(=O)N(C1=O)C
ZINC000101122144
ZINC13769766
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