Vitas-M small molecule compound
N-{[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Catalog ID
STK173557
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(ccc1C)c1nc2c(o1)cccc2
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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/c1-3-32-21-11-10-15(13-19(21)28(30)31)22(29)27-24(34)26-18-12-16(9-8-14(18)2)23-25-17-6-4-5-7-20(17)33-23/h4-13H,3H2,1-2H3,(H2,26,27,29,34)InChIKey
JLAXWVDMZRPBAK-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cc(ccc1C)c1nc2c(o1)cccc2
InChI=1SC24H20N4O5Sc133221111015(1319(21)28(30)31)22(29)2724(34)26181216(9814(18)2)232517645720(17)3323h413H3H212H3(H226272934)
MFCD02820670
N((5(13BENZOXAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)4ETHOXY3NITROBENZAMIDE
ZINC000002984868
ZINC02984868
ZINC2984868
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