Vitas-M small molecule compound
4-methoxy-N-{[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK084147
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1scc(n1)c1cccc2c1cccc2
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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 C22H16N4O4S2 MW 464.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4S2/c1-30-19-10-9-14(11-18(19)26(28)29)20(27)24-21(31)25-22-23-17(12-32-22)16-8-4-6-13-5-2-3-7-15(13)16/h2-12H,1H3,(H2,23,24,25,27,31)InChIKey
OKAIRAJUYSJDPR-UHFFFAOYSA-NSynonyms
4METHOXYN((4(NAPHTHALEN1YL)13THIAZOL2YL)CARBAMOTHIOYL)3NITROBENZAMIDE
4METHOXYN((4NAPHTHALEN1YL13THIAZOL2YL)CARBAMOTHIOYL)3NITROBENZAMIDE
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC4=CC=CC=C43)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1scc(n1)c1cccc2c1cccc2
InChI=1SC22H16N4O4S2c1301910914(1118(19)26(28)29)20(27)2421(31)25222317(123222)1684613523715(13)16h212H1H3(H22324252731)
MFCD03109721
STK084147
ZINC000002996866
ZINC02996866
ZINC2996866
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