Vitas-M small molecule compound
4-ethoxy-N-{[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK180560
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)C
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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 C24H20N4O5S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O5S/c1-3-32-21-10-8-16(12-19(21)28(30)31)22(29)27-24(34)25-17-9-11-20-18(13-17)26-23(33-20)15-6-4-14(2)5-7-15/h4-13H,3H2,1-2H3,(H2,25,27,29,34)InChIKey
XJJRSWCLJHOBSG-UHFFFAOYSA-NSynonyms
4ETHOXYN((2(4METHYLPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3NITROBENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)C
InChI=1SC24H20N4O5Sc13322110816(1219(21)28(30)31)22(29)2724(34)25179112018(1317)2623(3320)156414(2)5715h413H3H212H3(H225272934)
MFCD02820596
ZINC000002987064
ZINC02987064
ZINC2987064
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