Vitas-M small molecule compound
N-[(4-bromonaphthalen-1-yl)carbamothioyl]-3,4-dimethoxybenzamide
Catalog ID
STL355387
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(c2c1cccc2)Br
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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 C20H17BrN2O3S MW 445.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O3S/c1-25-17-10-7-12(11-18(17)26-2)19(24)23-20(27)22-16-9-8-15(21)13-5-3-4-6-14(13)16/h3-11H,1-2H3,(H2,22,23,24,27)InChIKey
NNTGIVMWDYPCJT-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C3=CC=CC=C32)Br)OC
InChI=1SC20H17BrN2O3Sc1251710712(1118(17)262)19(24)2320(27)22169815(21)13534614(13)16h311H12H3(H222232427)
MFCD02628241
N((4bromonaphthalen1yl)carbamothioyl)34dimethoxybenzamide
ZINC000001182523
ZINC01182523
ZINC1182523
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