Vitas-M small molecule compound
ethyl 4-({N'-cyano-N-[3-(trifluoromethyl)phenyl]carbamimidoyl}sulfanyl)-3-oxobutanoate
Catalog ID
STL326075
SMILES CCOC(=O)CC(=O)CS/C(=N\C#N)/Nc1cccc(c1)C(F)(F)F
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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 C15H14F3N3O3S MW 373.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14F3N3O3S/c1-2-24-13(23)7-12(22)8-25-14(20-9-19)21-11-5-3-4-10(6-11)15(16,17)18/h3-6H,2,7-8H2,1H3,(H,20,21)InChIKey
SPLHVRFZJJEDPV-UHFFFAOYSA-NSynonyms
372086-20-9(Z)ethyl4((NcyanoN(3(trifluoromethyl)phenyl)carbamimidoyl)thio)3oxobutanoate
CCOC(=O)CC(=O)CSC(=NC#N)Nc1cccc(c1)C(F)(F)F
CCOC(=O)CC(=O)CSC(=NC1=CC=CC(=C1)C(F)(F)F)NC#N
ETHYL4((NCYANON(3(TRIFLUOROMETHYL)PHENYL)CARBAMIMIDOYL)SULFANYL)3OXOBUTANOATE
ETHYL4(NCYANON(3(TRIFLUOROMETHYL)PHENYL)CARBAMIMIDOYL)SULFANYL3OXOBUTANOATE
Registry IDs
MFCD01877226ZINC000005790878
ZINC5790878
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