Vitas-M small molecule compound
4-[(3-hydroxypropyl)carbamoyl]-1-[2-(4-methylphenyl)-2-oxoethyl]pyridinium bromide
Catalog ID
STL281432
SMILES OCCCNC(=O)c1cc[n+](cc1)CC(=O)c1ccc(cc1)C.[Br-]
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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 C18H21BrN2O3 MW 393.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O3.BrH/c1-14-3-5-15(6-4-14)17(22)13-20-10-7-16(8-11-20)18(23)19-9-2-12-21;/h3-8,10-11,21H,2,9,12-13H2,1H3;1HInChIKey
WAODBMAWBATSMG-UHFFFAOYSA-NSynonyms
4((3hydroxypropyl)carbamoyl)1(2(4methylphenyl)2oxoethyl)pyridiniumbromide
CC1=CC=C(C=C1)C(=O)C(N+)2=CC=C(C=C2)C(=O)NCCCO(Br)
InChI=1SC18H20N2O3BrHc1143515(6414)17(22)132010716(81120)18(23)19921221h38101121H291213H21H31H
MFCD00855647
N(3hydroxypropyl)1(2(4methylphenyl)2oxoethyl)pyridin1ium4carboxamidebromide
OCCCNC(=O)c1cc(n+)(cc1)CC(=O)c1ccc(cc1)C(Br)
ZINC000018203729
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