Vitas-M small molecule compound
4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl 4-methoxybenzenesulfonate
Catalog ID
STK899450
SMILES COc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C=C1C(=O)NC(=O)NC1=O
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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 C18H14N2O7S MW 402.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O7S/c1-26-12-6-8-14(9-7-12)28(24,25)27-13-4-2-11(3-5-13)10-15-16(21)19-18(23)20-17(15)22/h2-10H,1H3,(H2,19,20,21,22,23)InChIKey
KXDNDLKHXOGFOJ-UHFFFAOYSA-NSynonyms
347312-44-1(4((246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENYL)4METHOXYBENZENESULFONATE
347312441
4((246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenyl4methoxybenzenesulfonate
COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C3C(=O)NC(=O)NC3=O
InChI=1SC18H14N2O7Sc126126814(9712)28(2425)27134211(3513)101516(21)1918(23)2017(15)22h210H1H3(H21920212223)
MFCD02612048
ZINC000002783083
ZINC02783083
ZINC2783083
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