Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide
Catalog ID
STK006295
SMILES COc1cc(Cl)c(cc1NC(=O)/C=C/c1ccc2c(c1)OCO2)OC
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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 C18H16ClNO5 MW 361.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO5/c1-22-15-9-13(16(23-2)8-12(15)19)20-18(21)6-4-11-3-5-14-17(7-11)25-10-24-14/h3-9H,10H2,1-2H3,(H,20,21)/b6-4+InChIKey
FPSSOHWUQPJFNA-GQCTYLIASA-NSynonyms
349578-35-4(2E)3(13BENZODIOXOL5YL)N(4CHLORO25DIMETHOXYPHENYL)PROP2ENAMIDE
(2E)3(2HBENZO(34D)13DIOXOLAN5YL)N(4CHLORO25DIMETHOXYPHENYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(4CHLORO25DIMETHOXYPHENYL)PROP2ENAMIDE
349578354
COC1=CC(=C(C=C1NC(=O)C=CC2=CC3=C(C=C2)OCO3)OC)Cl
COc1cc(Cl)c(cc1NC(=O)C=Cc1ccc2c(c1)OCO2)OC
InChI=1SC18H16ClNO5c12215913(16(232)812(15)19)2018(21)6411351417(711)25102414h39H10H212H3(H2021)b64+
MFCD00121807
STK006295
ZINC000003179723
ZINC03179723
ZINC3179723
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