Vitas-M small molecule compound
2-({[(3-bromo-4-methylphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK122657
SMILES S=C(Nc1sc2c(c1C(=O)N)CCCC2)NC(=O)c1ccc(c(c1)Br)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 C18H18BrN3O2S2 MW 452.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O2S2/c1-9-6-7-10(8-12(9)19)16(24)21-18(25)22-17-14(15(20)23)11-4-2-3-5-13(11)26-17/h6-8H,2-5H2,1H3,(H2,20,23)(H2,21,22,24,25)InChIKey
BAXJIFILTBCBFG-UHFFFAOYSA-NSynonyms
2((((3bromo4methylphenyl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((3bromo4methylbenzoyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxamide
CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCCC3)C(=O)N)Br
InChI=1SC18H18BrN3O2S2c196710(812(9)19)16(24)2118(25)221714(15(20)23)11423513(11)2617h68H25H21H3(H22023)(H221222425)
MFCD03589871
ZINC000001128632
ZINC01128632
ZINC1128632
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