Vitas-M small molecule compound
2-[(E)-(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STL427246
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C\1/C(=O)ON=C1C
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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 C18H15NO5S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO5S/c1-12-7-9-15(10-8-12)25(21,22)24-17-6-4-3-5-14(17)11-16-13(2)19-23-18(16)20/h3-11H,1-2H3/b16-11+InChIKey
AQXZPZZTQWEMQL-LFIBNONCSA-NSynonyms
(2((E)(3METHYL5OXO12OXAZOL4YLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
2((E)(3methyl5oxo12oxazol4(5H)ylidene)methyl)phenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=C3C(=NOC3=O)C
Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1C=C1C(=O)ON=C1C
InChI=1SC18H15NO5Sc1127915(10812)25(2122)2417643514(17)111613(2)192318(16)20h311H12H3b1611+
MFCD01133156
ZINC000004838040
ZINC04838040
ZINC4838040
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