Vitas-M small molecule compound

2-({2-[(2-methylpropyl)sulfanyl]-1H-benzimidazol-1-yl}carbonyl)benzoic acid

Catalog ID
STK727000
SMILES CC(CSc1nc2c(n1C(=O)c1ccccc1C(=O)O)cccc2)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 C19H18N2O3S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S/c1-12(2)11-25-19-20-15-9-5-6-10-16(15)21(19)17(22)13-7-3-4-8-14(13)18(23)24/h3-10,12H,11H2,1-2H3,(H,23,24)
InChIKey
AZLDKMCVGIGDSK-UHFFFAOYSA-N
Synonyms
384358-97-8
2((2((2methylpropyl)sulfanyl)1Hbenzimidazol1yl)carbonyl)benzoicacid
2(2(2METHYLPROPYLSULFANYL)BENZIMIDAZOLE1CARBONYL)BENZOICACID
2(2(isobutylthio)1Hbenzo(d)imidazole1carbonyl)benzoicacid
384358978
CC(C)CSC1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O
InChI=1SC19H18N2O3Sc112(2)11251920159561016(15)21(19)17(22)13734814(13)18(23)24h31012H11H212H3(H2324)
MFCD03001070
ZINC000002312653
ZINC2312653

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Available files

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