Vitas-M small molecule compound

N-(2,5-dimethylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide

Catalog ID
STK865371
SMILES Cc1ccc(c(c1)NC(=O)C1(C)OC(=O)c2c(C1)cccc2)C

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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 C19H19NO3 MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO3/c1-12-8-9-13(2)16(10-12)20-18(22)19(3)11-14-6-4-5-7-15(14)17(21)23-19/h4-10H,11H2,1-3H3,(H,20,22)
InChIKey
QOMAFWDGZKDQFS-UHFFFAOYSA-N
Synonyms
844456-20-8
844456208
CC1=CC(=C(C=C1)C)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C
InChI=1SC19H19NO3c1128913(2)16(1012)2018(22)19(3)1114645715(14)17(21)2319h410H11H213H3(H2022)
MFCD04156128
N(25DIMETHYLPHENYL)(3METHYL1OXOISOCHROMAN3YL)CARBOXAMIDE
N(25dimethylphenyl)3methyl1oxo34dihydro1Hisochromene3carboxamide
N(25DIMETHYLPHENYL)3METHYL1OXO4HISOCHROMENE3CARBOXAMIDE
N(25dimethylphenyl)3methyl1oxoisochroman3carboxamide
ZINC000000533982
ZINC000000533983

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.