Vitas-M small molecule compound
(2E)-1-(4-methylphenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL400644
SMILES Cc1ccc(cc1)C(=O)/C=C/c1c(C)nn(c1C)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 C16H18N2O MW 254.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O/c1-11-5-7-14(8-6-11)16(19)10-9-15-12(2)17-18(4)13(15)3/h5-10H,1-4H3/b10-9+InChIKey
KONVRFIDFQMXMH-MDZDMXLPSA-NSynonyms
1005687-26-2(2E)1(4methylphenyl)3(135trimethyl1Hpyrazol4yl)prop2en1one
(E)1(4methylphenyl)3(135trimethylpyrazol4yl)prop2en1one
1005687262
CC1=CC=C(C=C1)C(=O)C=CC2=C(N(N=C2C)C)C
Cc1ccc(cc1)C(=O)C=Cc1c(C)nn(c1C)C
InChI=1SC16H18N2Oc1115714(8611)16(19)1091512(2)1718(4)13(15)3h510H14H3b109+
MFCD04135856
ZINC000006922776
ZINC06922776
ZINC6922776
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