Vitas-M small molecule compound
6-tert-butyl-2-({[(2-fluorophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK243928
SMILES S=C(NC(=O)c1ccccc1F)Nc1sc2c(c1C(=O)N)CCC(C2)C(C)(C)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 C21H24FN3O2S2 MW 433.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24FN3O2S2/c1-21(2,3)11-8-9-13-15(10-11)29-19(16(13)17(23)26)25-20(28)24-18(27)12-6-4-5-7-14(12)22/h4-7,11H,8-10H2,1-3H3,(H2,23,26)(H2,24,25,27,28)InChIKey
MBAVLLQZIJSXBF-UHFFFAOYSA-NSynonyms
6tertbutyl2((((2fluorophenyl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((2fluorobenzoyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=S)NC(=O)C3=CC=CC=C3F
InChI=1SC21H24FN3O2S2c121(23)11891315(1011)2919(16(13)17(23)26)2520(28)2418(27)12645714(12)22h4711H810H213H3(H22326)(H224252728)
MFCD03906712
ZINC000013843185
ZINC000013843189
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