Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)prop-2-enamide
Catalog ID
STK471669
SMILES O=C(/C=C/c1ccc(c(c1)Cl)Cl)NCc1ccc2c(c1)OCO2
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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 C17H13Cl2NO3 MW 350.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2NO3/c18-13-4-1-11(7-14(13)19)3-6-17(21)20-9-12-2-5-15-16(8-12)23-10-22-15/h1-8H,9-10H2,(H,20,21)/b6-3+InChIKey
YLOKSCSZUHEQSE-ZZXKWVIFSA-NSynonyms
(2E)N(13benzodioxol5ylmethyl)3(34dichlorophenyl)prop2enamide
(2E)N(2HBENZO(34D)13DIOXOLEN5YLMETHYL)3(34DICHLOROPHENYL)PROP2ENAMIDE
(E)N(13BENZODIOXOL5YLMETHYL)3(34DICHLOROPHENYL)PROP2ENAMIDE
C1OC2=C(O1)C=C(C=C2)CNC(=O)C=CC3=CC(=C(C=C3)Cl)Cl
InChI=1SC17H13Cl2NO3c18134111(714(13)19)3617(21)20912251516(812)23102215h18H910H2(H2021)b63+
MFCD01358919
O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc1ccc2c(c1)OCO2
ZINC000005678040
ZINC05678040
ZINC5678040
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