Vitas-M small molecule compound
3-({[(2-bromophenyl)carbonyl]carbamothioyl}amino)-4-methoxybenzoic acid
Catalog ID
STK106123
SMILES COc1ccc(cc1NC(=S)NC(=O)c1ccccc1Br)C(=O)O
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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 C16H13BrN2O4S MW 409.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN2O4S/c1-23-13-7-6-9(15(21)22)8-12(13)18-16(24)19-14(20)10-4-2-3-5-11(10)17/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)InChIKey
IVNQQSMBVKGYIY-UHFFFAOYSA-NSynonyms
3((((2BROMOPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)4METHOXYBENZOICACID
3((2BROMOBENZOYL)CARBAMOTHIOYLAMINO)4METHOXYBENZOICACID
COC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=CC=C2Br
InChI=1SC16H13BrN2O4Sc12313769(15(21)22)812(13)1816(24)1914(20)10423511(10)17h28H1H3(H2122)(H218192024)
MFCD03573880
ZINC000001159504
ZINC1159504
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