Vitas-M small molecule compound
3-bromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
Catalog ID
STK390590
SMILES COc1ccc(cc1Br)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 C21H17BrN2O2S MW 441.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O2S/c1-26-18-10-8-14(11-16(18)22)20(25)24-21(27)23-17-9-7-13-6-5-12-3-2-4-15(17)19(12)13/h2-4,7-11H,5-6H2,1H3,(H2,23,24,25,27)InChIKey
LYCCYLUZIWOFFL-UHFFFAOYSA-NSynonyms
3bromoN(12dihydroacenaphthylen5ylcarbamothioyl)4methoxybenzamide
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2)Br
InChI=1SC21H17BrN2O2Sc1261810814(1116(18)22)20(25)2421(27)23179713651232415(17)19(12)13h24711H56H21H3(H223242527)
MFCD02810544
N((ACENAPHTHEN5YLAMINO)THIOXOMETHYL)(3BROMO4METHOXYPHENYL)CARBOXAMIDE
ZINC000002982506
ZINC02982506
ZINC2982506
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