Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}quinoline-4-carboxamide
Catalog ID
STK962049
SMILES Brc1cnn(c1)Cc1ccc(cc1)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2
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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 C27H19BrN4O3 MW 527.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19BrN4O3/c28-19-13-29-32(15-19)14-17-5-8-20(9-6-17)30-27(33)22-12-24(31-23-4-2-1-3-21(22)23)18-7-10-25-26(11-18)35-16-34-25/h1-13,15H,14,16H2,(H,30,33)InChIKey
CXWGZBGGVKKIAM-UHFFFAOYSA-NSynonyms
(2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL))N(4((4BROMOPYRAZOLYL)METHYL)PHENYL)CARBOXAMIDE
2(13BENZODIOXOL5YL)N(4((4BROMO1HPYRAZOL1YL)METHYL)PHENYL)QUINOLINE4CARBOXAMIDE
2(13BENZODIOXOL5YL)N(4((4BROMOPYRAZOL1YL)METHYL)PHENYL)QUINOLINE4CARBOXAMIDE
C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=C(C=C5)CN6C=C(C=N6)Br
InChI=1SC27H19BrN4O3c2819132932(1519)14175820(9617)3027(33)221224(3123421321(22)23)187102526(1118)35163425h11315H1416H2(H3033)
MFCD03233372
ZINC000002807599
ZINC2807599
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