Vitas-M small molecule compound
4-({[(3,5-dimethoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid
Catalog ID
STK061560
SMILES COc1cc(OC)cc(c1)C(=O)NC(=S)Nc1ccc(cc1)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 C17H16N2O5S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S/c1-23-13-7-11(8-14(9-13)24-2)15(20)19-17(25)18-12-5-3-10(4-6-12)16(21)22/h3-9H,1-2H3,(H,21,22)(H2,18,19,20,25)InChIKey
IEBPGEXXYSKKST-UHFFFAOYSA-NSynonyms
4((((35DIMETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4(((35DIMETHOXYBENZOYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4((35DIMETHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
COC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O)OC
COc1cc(OC)cc(c1)C(=O)NC(=S)Nc1ccc(cc1)C(=O)O
InChI=1SC17H16N2O5Sc12313711(814(913)242)15(20)1917(25)18125310(4612)16(21)22h39H12H3(H2122)(H218192025)
MFCD03574635
STK061560
ZINC000001159329
ZINC1159329
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