Vitas-M small molecule compound
N-(4-butylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Catalog ID
STL120554
SMILES CCCCc1ccc(cc1)NC(=O)C1(C)OC(=O)c2c(C1)cccc2
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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 C21H23NO3 MW 337.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO3/c1-3-4-7-15-10-12-17(13-11-15)22-20(24)21(2)14-16-8-5-6-9-18(16)19(23)25-21/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,22,24)InChIKey
GZXXACJIMNAYCV-UHFFFAOYSA-NSynonyms
(3R)N(4BUTYLPHENYL)3METHYL1OXO34DIHYDRO1HISOCHROMENE3CARBOXAMIDE
CCCCC1=CC=C(C=C1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C
InChI=1SC21H23NO3c134715101217(131115)2220(24)21(2)1416856918(16)19(23)2521h56813H34714H212H3(H2224)
MFCD04155122
N(4BUTYLPHENYL)(3METHYL1OXOISOCHROMAN3YL)CARBOXAMIDE
N(4butylphenyl)3methyl1oxo34dihydro1Hisochromene3carboxamide
N(4BUTYLPHENYL)3METHYL1OXO4HISOCHROMENE3CARBOXAMIDE
ZINC000002400424
ZINC000002400425
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