Vitas-M small molecule compound
2-(morpholin-4-ylcarbonothioyl)phenyl 3-nitrobenzoate
Catalog ID
STL383904
SMILES S=C(c1ccccc1OC(=O)c1cccc(c1)[N+](=O)[O-])N1CCOCC1
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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 C18H16N2O5S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5S/c21-18(13-4-3-5-14(12-13)20(22)23)25-16-7-2-1-6-15(16)17(26)19-8-10-24-11-9-19/h1-7,12H,8-11H2InChIKey
IBISNWSJGIZYHI-UHFFFAOYSA-NSynonyms
6069-76-7(2(MORPHOLINE4CARBOTHIOYL)PHENYL)3NITROBENZOATE
2(morpholin4ylcarbonothioyl)phenyl3nitrobenzoate
3NITROBENZOICACID2(MORPHOLINE4CARBOTHIOYL)PHENYLESTER
6069767
C1COCCN1C(=S)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC18H16N2O5Sc2118(1343514(1213)20(22)23)2516721615(16)17(26)198102411919h1712H811H2
MFCD01062438
S=C(c1ccccc1OC(=O)c1cccc(c1)(N+)(=O)(O))N1CCOCC1
ZINC000000866320
ZINC00866320
ZINC866320
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