Vitas-M small molecule compound
cyclopentyl 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK406853
SMILES O=C1NC(=C(C(C1)c1cc2OCOc2cc1Br)C(=O)OC1CCCC1)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 C19H20BrNO5 MW 422.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO5/c1-10-18(19(23)26-11-4-2-3-5-11)13(7-17(22)21-10)12-6-15-16(8-14(12)20)25-9-24-15/h6,8,11,13H,2-5,7,9H2,1H3,(H,21,22)InChIKey
CFVSDBPBNXQZKY-UHFFFAOYSA-NSynonyms
CC1=C(C(CC(=O)N1)C2=CC3=C(C=C2Br)OCO3)C(=O)OC4CCCC4
CYCLOPENTYL4(6BROMO(2HBENZO(D)13DIOXOLAN5YL))2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
cyclopentyl4(6bromo13benzodioxol5yl)2methyl6oxo1456tetrahydropyridine3carboxylate
cyclopentyl4(6bromo13benzodioxol5yl)6methyl2oxo34dihydro1Hpyridine5carboxylate
InChI=1SC19H20BrNO5c11018(19(23)2611423511)13(717(22)2110)1261516(814(12)20)2592415h681113H2579H21H3(H2122)
MFCD07613408
ZINC000009560013
ZINC000009560014
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