Vitas-M small molecule compound
(4E)-4-(3,4-dihydro-2H-chromen-6-ylmethylidene)-1-phenylpyrazolidine-3,5-dione
Catalog ID
STL295933
SMILES O=C1NN(C(=O)/C/1=C/c1ccc2c(c1)CCCO2)c1ccccc1
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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 C19H16N2O3 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3/c22-18-16(19(23)21(20-18)15-6-2-1-3-7-15)12-13-8-9-17-14(11-13)5-4-10-24-17/h1-3,6-9,11-12H,4-5,10H2,(H,20,22)/b16-12+InChIKey
BGBRYPCPBMJADT-FOWTUZBSSA-NSynonyms
(4E)4(34dihydro2Hchromen6ylmethylidene)1phenylpyrazolidine35dione
C1CC2=C(C=CC(=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)OC1
InChI=1SC19H16N2O3c221816(19(23)21(2018)156213715)1213891714(1113)54102417h13691112H4510H2(H2022)b1612+
MFCD28033219
O=C1NN(C(=O)C1=Cc1ccc2c(c1)CCCO2)c1ccccc1
ZINC000095471139
ZINC95471139
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