Vitas-M small molecule compound
ethyl (2Z)-3-amino-2-[(2,5-dichlorophenyl)carbamothioyl]but-2-enoate
Catalog ID
STK449415
SMILES CCOC(=O)/C(=C(/N)\C)/C(=S)Nc1cc(Cl)ccc1Cl
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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 C13H14Cl2N2O2S MW 333.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14Cl2N2O2S/c1-3-19-13(18)11(7(2)16)12(20)17-10-6-8(14)4-5-9(10)15/h4-6H,3,16H2,1-2H3,(H,17,20)/b11-7+InChIKey
UHYVFNLFXZHHKH-YRNVUSSQSA-NSynonyms
CCOC(=O)C(=C(C)N)C(=S)NC1=C(C=CC(=C1)Cl)Cl
CCOC(=O)C(=C(N)C)C(=S)Nc1cc(Cl)ccc1Cl
ETHYL(2Z)3AMINO2(((25DICHLOROPHENYL)AMINO)THIOXOMETHYL)BUT2ENOATE
ethyl(2Z)3amino2((25dichlorophenyl)carbamothioyl)but2enoate
ETHYL(Z)3AMINO2((25DICHLOROPHENYL)CARBAMOTHIOYL)BUT2ENOATE
ETHYL3AMINO2((25DICHLOROANILINO)CARBOTHIOYL)2BUTENOATE
InChI=1SC13H14Cl2N2O2Sc131913(18)11(7(2)16)12(20)171068(14)459(10)15h46H316H212H3(H1720)b117+
MFCD03466975
ZINC000102258778
ZINC102258778
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