Vitas-M small molecule compound
N-(3,5-dichlorophenyl)-2-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Catalog ID
STK586013
SMILES O=C(Nc1cc(Cl)cc(c1)Cl)CN1CCc2c(C1C)cc1c(c2)OCCCO1
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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 C21H22Cl2N2O3 MW 421.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N2O3/c1-13-18-11-20-19(27-5-2-6-28-20)7-14(18)3-4-25(13)12-21(26)24-17-9-15(22)8-16(23)10-17/h7-11,13H,2-6,12H2,1H3,(H,24,26)InChIKey
PUHDMJIPMKOGKK-UHFFFAOYSA-NSynonyms
898918-63-3898918633
CC1C2=CC3=C(C=C2CCN1CC(=O)NC4=CC(=CC(=C4)Cl)Cl)OCCCO3
InChI=1SC21H22Cl2N2O3c11318112019(275262820)714(18)3425(13)1221(26)2417915(22)816(23)1017h71113H2612H21H3(H2426)
MFCD07638957
N(35dichlorophenyl)2(7methyl2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)acetamide
N(35dichlorophenyl)2(7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)acetamide
ZINC000005423542
ZINC000005423545
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