Vitas-M small molecule compound
(2E)-3-phenyl-N-{2,2,2-trichloro-1-[(naphthalen-1-ylcarbamothioyl)amino]ethyl}prop-2-enamide
Catalog ID
STK387368
SMILES O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc2c1cccc2)/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)14-13-15-7-2-1-3-8-15)28-21(30)26-18-12-6-10-16-9-4-5-11-17(16)18/h1-14,20H,(H,27,29)(H2,26,28,30)/b14-13+InChIKey
ZLZQTGPGCUPNJE-BUHFOSPRSA-NSynonyms
(2E)3PHENYLN(222TRICHLORO1((NAPHTHALEN1YLCARBAMOTHIOYL)AMINO)ETHYL)PROP2ENAMIDE
(E)3PHENYLN(222TRICHLORO1(NAPHTHALEN1YLCARBAMOTHIOYLAMINO)ETHYL)PROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=CC=CC=C32
InChI=1SC22H18Cl3N3OSc2322(2425)20(2719(29)1413157213815)2821(30)261812610169451117(16)18h11420H(H2729)(H2262830)b1413+
MFCD00340064
O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc2c1cccc2)C=Cc1ccccc1
ZINC000002687917
ZINC000002687921
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