Vitas-M small molecule compound
(2E)-N-(3-chloro-4-methylphenyl)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enamide
Catalog ID
STK949381
SMILES N#C/C(=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)/C(=O)Nc1ccc(c(c1)Cl)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 C21H13Cl2N3O4 MW 442.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N3O4/c1-12-2-4-15(10-18(12)23)25-21(27)14(11-24)8-16-5-7-20(30-16)13-3-6-17(22)19(9-13)26(28)29/h2-10H,1H3,(H,25,27)/b14-8+InChIKey
STQPPSUJKSGRRB-RIYZIHGNSA-NSynonyms
(2E)N(3CHLORO4METHYLPHENYL)3(5(4CHLORO3NITROPHENYL)(2FURYL))2CYANOPROP2ENAMIDE
(2E)N(3chloro4methylphenyl)3(5(4chloro3nitrophenyl)furan2yl)2cyanoprop2enamide
(E)N(3CHLORO4METHYLPHENYL)3(5(4CHLORO3NITROPHENYL)FURAN2YL)2CYANOPROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C#N)Cl
InChI=1SC21H13Cl2N3O4c1122415(1018(12)23)2521(27)14(1124)8165720(3016)133617(22)19(913)26(28)29h210H1H3(H2527)b148+
MFCD04182858
N#CC(=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)Nc1ccc(c(c1)Cl)C
ZINC000001453265
ZINC01453265
ZINC1453265
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