Vitas-M small molecule compound
3-[3-(2,4-dimethylphenyl)-4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl]propanoic acid
Catalog ID
STL294775
SMILES OC(=O)CCn1c(=O)cc(n(c1=O)c1ccc(cc1C)C)C
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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 C16H18N2O4 MW 302.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4/c1-10-4-5-13(11(2)8-10)18-12(3)9-14(19)17(16(18)22)7-6-15(20)21/h4-5,8-9H,6-7H2,1-3H3,(H,20,21)InChIKey
KMDPWVKQGJCEJB-UHFFFAOYSA-NSynonyms
3(3(24dimethylphenyl)4methyl26dioxo36dihydropyrimidin1(2H)yl)propanoicacid
3(3(24dimethylphenyl)4methyl26dioxopyrimidin1yl)propanoicacid
CC1=CC(=C(C=C1)N2C(=CC(=O)N(C2=O)CCC(=O)O)C)C
InChI=1SC16H18N2O4c1104513(11(2)810)1812(3)914(19)17(16(18)22)7615(20)21h4589H67H213H3(H2021)
MFCD27966437
ZINC000095470845
ZINC95470845
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