Vitas-M small molecule compound

3-({[(5-bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid

Catalog ID
STK110070
SMILES COc1ccc(cc1C(=O)NC(=S)Nc1cccc(c1)C(=O)O)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 C16H13BrN2O4S MW 409.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN2O4S/c1-23-13-6-5-10(17)8-12(13)14(20)19-16(24)18-11-4-2-3-9(7-11)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)
InChIKey
RDLQNEYHFDLVPH-UHFFFAOYSA-N
Synonyms
433690-89-2
3((((5BROMO2METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
3((5BROMO2METHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
433690892
BENZOICACID3((((5BROMO2METHOXYBENZOYL)AMINO)THIOXOMETHYL)AMINO)
COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)O
InChI=1SC16H13BrN2O4Sc123136510(17)812(13)14(20)1916(24)18114239(711)15(21)22h28H1H3(H2122)(H218192024)
MFCD03246192
ZINC000004675166
ZINC4675166

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Available files

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