Vitas-M small molecule compound
(2E)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-(1-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL397953
SMILES CCn1ncc(c1C)/C=C/C(=O)c1cnn(c1)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 C13H16N4O MW 244.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O/c1-4-17-10(2)11(7-15-17)5-6-13(18)12-8-14-16(3)9-12/h5-9H,4H2,1-3H3/b6-5+InChIKey
JJVADHLQEWZNIK-AATRIKPKSA-NSynonyms
1005703-39-8(2E)3(1ETHYL5METHYL1HPYRAZOL4YL)1(1METHYL1HPYRAZOL4YL)PROP2EN1ONE
(E)3(1ethyl5methylpyrazol4yl)1(1methylpyrazol4yl)prop2en1one
1005703398
CCN1C(=C(C=N1)C=CC(=O)C2=CN(N=C2)C)C
CCn1ncc(c1C)C=CC(=O)c1cnn(c1)C
InChI=1SC13H16N4Oc141710(2)11(71517)5613(18)1281416(3)912h59H4H213H3b65+
MFCD04054188
ZINC000006490026
ZINC06490026
ZINC6490026
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