Vitas-M small molecule compound
N-[(3-acetylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK089787
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cccc(c1)C(=O)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 C18H17N3O5S MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O5S/c1-3-26-16-8-7-13(10-15(16)21(24)25)17(23)20-18(27)19-14-6-4-5-12(9-14)11(2)22/h4-10H,3H2,1-2H3,(H2,19,20,23,27)InChIKey
LQTINJSAPGURID-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cccc(c1)C(=O)C
InChI=1SC18H17N3O5Sc1326168713(1015(16)21(24)25)17(23)2018(27)191464512(914)11(2)22h410H3H212H3(H219202327)
MFCD02626961
N((3ACETYLPHENYL)CARBAMOTHIOYL)4ETHOXY3NITROBENZAMIDE
STK089787
ZINC000001174273
ZINC01174273
ZINC1174273
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