Vitas-M small molecule compound
2-(3-cyano-1H-indol-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
Catalog ID
STL430899
SMILES N#Cc1cn(c2c1cccc2)CC(=O)Nc1ccc2c(c1)OCCCO2
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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 C20H17N3O3 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3/c21-11-14-12-23(17-5-2-1-4-16(14)17)13-20(24)22-15-6-7-18-19(10-15)26-9-3-8-25-18/h1-2,4-7,10,12H,3,8-9,13H2,(H,22,24)InChIKey
NSJHFOXPOFDCCU-UHFFFAOYSA-NSynonyms
2(3cyano1Hindol1yl)N(34dihydro2H15benzodioxepin7yl)acetamide
2(3cyanoindol1yl)N(34dihydro2H15benzodioxepin7yl)acetamide
C1COC2=C(C=C(C=C2)NC(=O)CN3C=C(C4=CC=CC=C43)C#N)OC1
InChI=1SC20H17N3O3c2111141223(17521416(14)17)1320(24)2215671819(1015)269382518h12471012H38913H2(H2224)
MFCD09871085
ZINC000009028107
ZINC09028107
ZINC9028107
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