Vitas-M small molecule compound
N-[(2,5-dimethylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK050101
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(C)ccc1C
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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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c1-4-25-16-8-7-13(10-15(16)21(23)24)17(22)20-18(26)19-14-9-11(2)5-6-12(14)3/h5-10H,4H2,1-3H3,(H2,19,20,22,26)InChIKey
VIHMLZKCGZKUJN-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cc(C)ccc1C
InChI=1SC18H19N3O4Sc1425168713(1015(16)21(23)24)17(22)2018(26)1914911(2)5612(14)3h510H4H213H3(H219202226)
MFCD02626943
N((25DIMETHYLPHENYL)CARBAMOTHIOYL)4ETHOXY3NITROBENZAMIDE
STK050101
ZINC000001173166
ZINC01173166
ZINC1173166
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