Vitas-M small molecule compound
ethyl 4-{[(3,4-dichlorophenyl)carbamothioyl]amino}-4-oxobutanoate
Catalog ID
STL062537
SMILES CCOC(=O)CCC(=O)NC(=S)Nc1ccc(c(c1)Cl)Cl
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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 C13H14Cl2N2O3S MW 349.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14Cl2N2O3S/c1-2-20-12(19)6-5-11(18)17-13(21)16-8-3-4-9(14)10(15)7-8/h3-4,7H,2,5-6H2,1H3,(H2,16,17,18,21)InChIKey
LHANIRNNNLZTNX-UHFFFAOYSA-NSynonyms
CCOC(=O)CCC(=O)NC(=S)NC1=CC(=C(C=C1)Cl)Cl
ethyl4(((34dichlorophenyl)carbamothioyl)amino)4oxobutanoate
ETHYL4((34DICHLOROPHENYL)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
InChI=1SC13H14Cl2N2O3Sc122012(19)6511(18)1713(21)168349(14)10(15)78h347H256H21H3(H216171821)
MFCD03588946
ZINC000005979606
ZINC05979606
ZINC5979606
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