Vitas-M small molecule compound
(2E)-1-(1-methyl-1H-pyrazol-5-yl)-3-[4-(propan-2-yloxy)phenyl]prop-2-en-1-one
Catalog ID
STL390475
SMILES CC(Oc1ccc(cc1)/C=C/C(=O)c1ccnn1C)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 C16H18N2O2 MW 270.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O2/c1-12(2)20-14-7-4-13(5-8-14)6-9-16(19)15-10-11-17-18(15)3/h4-12H,1-3H3/b9-6+InChIKey
MFBGMAGXGPXETG-RMKNXTFCSA-NSynonyms
1005688-85-6(2E)1(1methyl1Hpyrazol5yl)3(4(propan2yloxy)phenyl)prop2en1one
(E)1(2methylpyrazol3yl)3(4propan2yloxyphenyl)prop2en1one
1005688856
CC(C)OC1=CC=C(C=C1)C=CC(=O)C2=CC=NN2C
CC(Oc1ccc(cc1)C=CC(=O)c1ccnn1C)C
InChI=1SC16H18N2O2c112(2)20147413(5814)6916(19)1510111718(15)3h412H13H3b96+
MFCD04136024
ZINC000006263060
ZINC06263060
ZINC6263060
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