Vitas-M small molecule compound
N-{[2-(2-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-methyl-3-nitrobenzamide
Catalog ID
STK184175
SMILES S=C(NC(=O)c1cccc(c1C)[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1ccccc1F
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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 C22H15FN4O4S MW 450.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15FN4O4S/c1-12-14(6-4-8-18(12)27(29)30)20(28)26-22(32)24-13-9-10-19-17(11-13)25-21(31-19)15-5-2-3-7-16(15)23/h2-11H,1H3,(H2,24,26,28,32)InChIKey
LHRIKKRVSQANBE-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4F
InChI=1SC22H15FN4O4Sc11214(64818(12)27(29)30)20(28)2622(32)24139101917(1113)2521(3119)15523716(15)23h211H1H3(H224262832)
MFCD02923079
N((2(2FLUOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)2METHYL3NITROBENZAMIDE
S=C(NC(=O)c1cccc(c1C)(N+)(=O)(O))Nc1ccc2c(c1)nc(o2)c1ccccc1F
ZINC000001181270
ZINC01181270
ZINC1181270
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