Vitas-M small molecule compound
N-(3-cyanophenyl)-2-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Catalog ID
STK576381
SMILES N#Cc1cccc(c1)NC(=O)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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c1-15-19-12-21-20(27-8-3-9-28-21)11-17(19)6-7-25(15)14-22(26)24-18-5-2-4-16(10-18)13-23/h2,4-5,10-12,15H,3,6-9,14H2,1H3,(H,24,26)InChIKey
GAIAQWRWVRAJJR-UHFFFAOYSA-NSynonyms
883950-70-7883950707
CC1C2=CC3=C(C=C2CCN1CC(=O)NC4=CC=CC(=C4)C#N)OCCCO3
InChI=1SC22H23N3O3c11519122120(278392821)1117(19)6725(15)1422(26)241852416(1018)1323h245101215H36914H21H3(H2426)
MFCD07638831
N(3cyanophenyl)2(7methyl2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)acetamide
N(3cyanophenyl)2(7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)acetamide
ZINC000005422895
ZINC000005422900
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