Vitas-M small molecule compound
3,5-dichloro-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
Catalog ID
STK248611
SMILES COc1c(Cl)cc(cc1Cl)C(=O)NC(=S)Nc1ccc2c3c1cccc3CC2
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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 C21H16Cl2N2O2S MW 431.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O2S/c1-27-19-15(22)9-13(10-16(19)23)20(26)25-21(28)24-17-8-7-12-6-5-11-3-2-4-14(17)18(11)12/h2-4,7-10H,5-6H2,1H3,(H2,24,25,26,28)InChIKey
LRUAKNNVXQYYIS-UHFFFAOYSA-NSynonyms
35dichloroN(12dihydroacenaphthylen5ylcarbamothioyl)4methoxybenzamide
COC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2)Cl
InChI=1SC21H16Cl2N2O2Sc1271915(22)913(1016(19)23)20(26)2521(28)24178712651132414(17)18(11)12h24710H56H21H3(H224252628)
MFCD02810170
ZINC000009668145
ZINC09668145
ZINC9668145
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