Vitas-M small molecule compound
4-chloro-3-[(pentanoylcarbamothioyl)amino]benzoic acid
Catalog ID
STK109249
SMILES CCCCC(=O)NC(=S)Nc1cc(ccc1Cl)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 C13H15ClN2O3S MW 314.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN2O3S/c1-2-3-4-11(17)16-13(20)15-10-7-8(12(18)19)5-6-9(10)14/h5-7H,2-4H2,1H3,(H,18,19)(H2,15,16,17,20)InChIKey
BEGMWNROCZFZNF-UHFFFAOYSA-NSynonyms
532430-52-74CHLORO3(((PENTANOYLAMINO)CARBONOTHIOYL)AMINO)BENZOICACID
4CHLORO3((PENTANOYLCARBAMOTHIOYL)AMINO)BENZOICACID
4CHLORO3(PENTANOYLCARBAMOTHIOYLAMINO)BENZOICACID
532430527
BENZOICACID4CHLORO3((((1OXOPENTYL)AMINO)THIOXOMETHYL)AMINO)
CCCCC(=O)NC(=S)NC1=C(C=CC(=C1)C(=O)O)Cl
InChI=1SC13H15ClN2O3Sc123411(17)1613(20)151078(12(18)19)569(10)14h57H24H21H3(H1819)(H215161720)
MFCD03570128
ZINC000002833591
ZINC2833591
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