Vitas-M small molecule compound
N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-oxo-2H-chromene-3-carboxamide
Catalog ID
STK572104
SMILES Brc1cccc(c1)CN(C(=O)c1cc2ccccc2oc1=O)C1CCS(=O)(=O)C1
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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 C21H18BrNO5S MW 476.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO5S/c22-16-6-3-4-14(10-16)12-23(17-8-9-29(26,27)13-17)20(24)18-11-15-5-1-2-7-19(15)28-21(18)25/h1-7,10-11,17H,8-9,12-13H2InChIKey
XGPDDKSVSJCZLH-UHFFFAOYSA-NSynonyms
850188-54-42OXO2HCHROMENE3CARBOXYLICACID(3BROMOBENZYL)(11DIOXOTETRAHYDRO1LAMBDA6THIOPHEN3YL)AMIDE
850188544
C1CS(=O)(=O)CC1N(CC2=CC(=CC=C2)Br)C(=O)C3=CC4=CC=CC=C4OC3=O
InChI=1SC21H18BrNO5Sc221663414(1016)1223(178929(2627)1317)20(24)181115512719(15)2821(18)25h17101117H891213H2
MFCD05690383
N((3BROMOPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)2OXOCHROMENE3CARBOXAMIDE
N(3bromobenzyl)N(11dioxidotetrahydrothiophen3yl)2oxo2Hchromene3carboxamide
ZINC000013132842
ZINC000013132843
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