Vitas-M small molecule compound
dimethyl 5-{[(2-methylbutyl)carbamothioyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK207228
SMILES CCC(CNC(=S)Nc1cc(cc(c1)C(=O)OC)C(=O)OC)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 C16H22N2O4S MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O4S/c1-5-10(2)9-17-16(23)18-13-7-11(14(19)21-3)6-12(8-13)15(20)22-4/h6-8,10H,5,9H2,1-4H3,(H2,17,18,23)InChIKey
ABTDHYDRTFKSAK-UHFFFAOYSA-NSynonyms
CCC(C)CNC(=S)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC
dimethyl5(((2methylbutyl)carbamothioyl)amino)benzene13dicarboxylate
dimethyl5(2methylbutylcarbamothioylamino)benzene13dicarboxylate
InChI=1SC16H22N2O4Sc1510(2)91716(23)1813711(14(19)213)612(813)15(20)224h6810H59H214H3(H2171823)
METHYL3(METHOXYCARBONYL)5((((2METHYLBUTYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
MFCD06754529
ZINC000004741440
ZINC000004741441
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