Vitas-M small molecule compound
2-bromo-4-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-6-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK398406
SMILES COc1cc(C=C2C(=O)N(C)C(=O)N(C2=O)C)cc(c1OS(=O)(=O)c1ccc(cc1)C)Br
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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 C21H19BrN2O7S MW 523.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O7S/c1-12-5-7-14(8-6-12)32(28,29)31-18-16(22)10-13(11-17(18)30-4)9-15-19(25)23(2)21(27)24(3)20(15)26/h5-11H,1-4H3InChIKey
QQGXWTBVMVOIPV-UHFFFAOYSA-NSynonyms
(2bromo4((13dimethyl246trioxo13diazinan5ylidene)methyl)6methoxyphenyl)4methylbenzenesulfonate
2BROMO4((13DIMETHYL246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)6METHOXYPHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=C3C(=O)N(C(=O)N(C3=O)C)C)OC
InChI=1SC21H19BrN2O7Sc1125714(8612)32(2829)311816(22)1013(1117(18)304)91519(25)23(2)21(27)24(3)20(15)26h511H14H3
MFCD11853728
ZINC000059222220
ZINC59222220
Check stock
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