Vitas-M small molecule compound
ethyl 4-cyano-3-methyl-5-{[(phenylcarbonyl)carbamothioyl]amino}thiophene-2-carboxylate
Catalog ID
STL079777
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=S)NC(=O)c1ccccc1
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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 C17H15N3O3S2 MW 373.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O3S2/c1-3-23-16(22)13-10(2)12(9-18)15(25-13)20-17(24)19-14(21)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3,(H2,19,20,21,24)InChIKey
VSMDCBDYWZFDPF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C(=C(S1)NC(=S)NC(=O)C2=CC=CC=C2)C#N)C
ethyl4cyano3methyl5(((phenylcarbonyl)carbamothioyl)amino)thiophene2carboxylate
ETHYL4CYANO3METHYL5(((PHENYLCARBONYLAMINO)THIOXOMETHYL)AMINO)THIOPHENE2CARBOXYLATE
ethyl5(benzoylcarbamothioylamino)4cyano3methylthiophene2carboxylate
InChI=1SC17H15N3O3S2c132316(22)1310(2)12(918)15(2513)2017(24)1914(21)117546811h48H3H212H3(H219202124)
MFCD18200605
ZINC000035682008
ZINC35682008
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