Vitas-M small molecule compound
3-[(2E)-3-(1-propyl-1H-pyrazol-4-yl)prop-2-enoyl]-2H-chromen-2-one
Catalog ID
STL181703
SMILES CCCn1ncc(c1)/C=C/C(=O)c1cc2ccccc2oc1=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 C18H16N2O3 MW 308.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3/c1-2-9-20-12-13(11-19-20)7-8-16(21)15-10-14-5-3-4-6-17(14)23-18(15)22/h3-8,10-12H,2,9H2,1H3/b8-7+InChIKey
XDMPMLRKVZEXLW-BQYQJAHWSA-NSynonyms
1263038-49-81263038498
3((2E)3(1propyl1Hpyrazol4yl)prop2enoyl)2Hchromen2one
3((2E)3(1PROPYLPYRAZOL4YL)PROP2ENOYL)CHROMEN2ONE
3((E)3(1propylpyrazol4yl)prop2enoyl)chromen2one
CCCN1C=C(C=N1)C=CC(=O)C2=CC3=CC=CC=C3OC2=O
CCCn1ncc(c1)C=CC(=O)c1cc2ccccc2oc1=O
InChI=1SC18H16N2O3c129201213(111920)7816(21)151014534617(14)2318(15)22h381012H29H21H3b87+
MFCD20760077
ZINC000071785025
ZINC71785025
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