Vitas-M small molecule compound
N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Catalog ID
STK037065
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)F
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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 C22H15FN4O5S MW 466.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15FN4O5S/c1-31-19-8-4-13(10-17(19)27(29)30)20(28)26-22(33)24-15-7-9-18-16(11-15)25-21(32-18)12-2-5-14(23)6-3-12/h2-11H,1H3,(H2,24,26,28,33)InChIKey
DBUVSBWKCFAGLR-UHFFFAOYSA-NSynonyms
333739-09-61(2(4FLUOROPHENYL)BENZOOXAZOL5YL)3(4METHOXY3NITROBENZOYL)THIOUREA
333739096
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)F)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)F
InChI=1SC22H15FN4O5Sc131198413(1017(19)27(29)30)20(28)2622(33)2415791816(1115)2521(3218)122514(23)6312h211H1H3(H224262833)
MFCD02578130
N(((2(4FLUOROPHENYL)BENZOXAZOL5YL)AMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N((2(4FLUOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((2(4fluorophenyl)benzo(d)oxazol5yl)carbamothioyl)4methoxy3nitrobenzamide
N(2(4FLUOROPHENYL)13BENZOXAZOL5YL)N(3NITRO4METHOXYBENZOYL)THIOUREA
STK037065
ZINC000002064382
ZINC02064382
ZINC2064382
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