Vitas-M small molecule compound
(2E)-3-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)prop-2-en-1-one
Catalog ID
STK701851
SMILES Cc1ccc(cc1)c1nn(cc1/C=C/C(=O)C12CC3CC(C2)CC(C1)C3)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 C29H30N2O MW 422.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O/c1-20-7-9-24(10-8-20)28-25(19-31(30-28)26-5-3-2-4-6-26)11-12-27(32)29-16-21-13-22(17-29)15-23(14-21)18-29/h2-12,19,21-23H,13-18H2,1H3/b12-11+InChIKey
CGHCUUYJBXCCHO-VAWYXSNFSA-NSynonyms
313272-54-7(2E)3(3(4methylphenyl)1phenyl1Hpyrazol4yl)1(tricyclo(3311~37~)dec1yl)prop2en1one
(E)1((3r5r7r)adamantan1yl)3(1phenyl3(ptolyl)1Hpyrazol4yl)prop2en1one
(E)1(1ADAMANTYL)3(3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)PROP2EN1ONE
313272547
CC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6
Cc1ccc(cc1)c1nn(cc1C=CC(=O)C12CC3CC(C2)CC(C1)C3)c1ccccc1
InChI=1SC29H30N2Oc1207924(10820)2825(1931(3028)265324626)111227(32)2916211322(1729)1523(1421)1829h212192123H1318H21H3b1211+
MFCD01956474
ZINC000004823112
ZINC04823112
ZINC4823112
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