Vitas-M small molecule compound
N-{[4-chloro-3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-nitrobenzamide
Catalog ID
STK163551
SMILES CCc1ccc2c(c1)nc(o2)c1cc(ccc1Cl)NC(=S)NC(=O)c1ccccc1[N+](=O)[O-]
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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 C23H17ClN4O4S MW 480.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O4S/c1-2-13-7-10-20-18(11-13)26-22(32-20)16-12-14(8-9-17(16)24)25-23(33)27-21(29)15-5-3-4-6-19(15)28(30)31/h3-12H,2H2,1H3,(H2,25,27,29,33)InChIKey
FPWZFIQTUXOZIT-UHFFFAOYSA-NSynonyms
CCC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC=CC=C4(N+)(=O)(O))Cl
CCc1ccc2c(c1)nc(o2)c1cc(ccc1Cl)NC(=S)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC23H17ClN4O4Sc12137102018(1113)2622(3220)161214(8917(16)24)2523(33)2721(29)15534619(15)28(30)31h312H2H21H3(H225272933)
MFCD02821777
N((4CHLORO3(5ETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)2NITROBENZAMIDE
ZINC000002985672
ZINC02985672
ZINC2985672
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