Vitas-M small molecule compound
3-(morpholin-4-ylcarbonothioyl)phenyl 3-nitrobenzoate
Catalog ID
STL383907
SMILES S=C(c1cccc(c1)OC(=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(14-4-1-5-15(11-14)20(22)23)25-16-6-2-3-13(12-16)17(26)19-7-9-24-10-8-19/h1-6,11-12H,7-10H2InChIKey
QZIWAMKUNUXLPB-UHFFFAOYSA-NSynonyms
(3(MORPHOLINE4CARBOTHIOYL)PHENYL)3NITROBENZOATE
3(morpholin4ylcarbonothioyl)phenyl3nitrobenzoate
3NITROBENZOICACID3(MORPHOLINE4CARBOTHIOYL)PHENYLESTER
C1COCCN1C(=S)C2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC18H16N2O5Sc2118(1441515(1114)20(22)23)251662313(1216)17(26)19792410819h161112H710H2
MFCD01062420
S=C(c1cccc(c1)OC(=O)c1cccc(c1)(N+)(=O)(O))N1CCOCC1
ZINC000000866314
ZINC00866314
ZINC866314
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