Vitas-M small molecule compound
2-chloro-6-methoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 2-nitrobenzoate
Catalog ID
STL383041
SMILES COc1cc(cc(c1OC(=O)c1ccccc1[N+](=O)[O-])Cl)C(=S)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 C19H17ClN2O6S MW 436.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN2O6S/c1-26-16-11-12(18(29)21-6-8-27-9-7-21)10-14(20)17(16)28-19(23)13-4-2-3-5-15(13)22(24)25/h2-5,10-11H,6-9H2,1H3InChIKey
HPONBMWMFHLIED-UHFFFAOYSA-NSynonyms
(2CHLORO6METHOXY4(MORPHOLINE4CARBOTHIOYL)PHENYL)2NITROBENZOATE
2chloro6methoxy4(morpholin4ylcarbonothioyl)phenyl2nitrobenzoate
COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OC(=O)C3=CC=CC=C3(N+)(=O)(O)
COc1cc(cc(c1OC(=O)c1ccccc1(N+)(=O)(O))Cl)C(=S)N1CCOCC1
InChI=1SC19H17ClN2O6Sc126161112(18(29)2168279721)1014(20)17(16)2819(23)13423515(13)22(24)25h251011H69H21H3
MFCD02581109
ZINC000001165949
ZINC01165949
ZINC1165949
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