Vitas-M small molecule compound
(2Z)-3-phenyl-N-{2,2,2-trichloro-1-[(naphthalen-2-ylcarbamothioyl)amino]ethyl}prop-2-enamide
Catalog ID
STK809688
SMILES O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc2c(c1)cccc2)/C=C\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 C22H18Cl3N3OS MW 478.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl3N3OS/c23-22(24,25)20(27-19(29)13-10-15-6-2-1-3-7-15)28-21(30)26-18-12-11-16-8-4-5-9-17(16)14-18/h1-14,20H,(H,27,29)(H2,26,28,30)/b13-10-InChIKey
ZNDKNEXFQBWQKO-RAXLEYEMSA-NSynonyms
(2Z)3phenylN(222trichloro1((naphthalen2ylcarbamothioyl)amino)ethyl)prop2enamide
(Z)3phenylN(222trichloro1(naphthalen2ylcarbamothioylamino)ethyl)prop2enamide
C1=CC=C(C=C1)C=CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC3=CC=CC=C3C=C2
InChI=1SC22H18Cl3N3OSc2322(2425)20(2719(29)1310156213715)2821(30)2618121116845917(16)1418h11420H(H2729)(H2262830)b1310
MFCD00696444
O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc2c(c1)cccc2)C=Cc1ccccc1
ZINC000016790907
ZINC000016790909
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