Vitas-M small molecule compound
ethyl 4-({[(3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STK148075
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1cccc(c1)[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 C17H15N3O5S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5S/c1-2-25-16(22)11-6-8-13(9-7-11)18-17(26)19-15(21)12-4-3-5-14(10-12)20(23)24/h3-10H,2H2,1H3,(H2,18,19,21,26)InChIKey
XMQWLMBQIJGUJK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1cccc(c1)(N+)(=O)(O)
ETHYL4((((3NITROPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
ETHYL4((3NITROBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC17H15N3O5Sc122516(22)116813(9711)1817(26)1915(21)1243514(1012)20(23)24h310H2H21H3(H218192126)
MFCD02918559
ZINC000005499816
ZINC05499816
ZINC5499816
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