Vitas-M small molecule compound
(4Z)-4-({3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK702967
SMILES CC(Oc1ccc(cc1C)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1)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 C35H30N4O2 MW 538.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O2/c1-24(2)41-32-20-19-27(21-25(32)3)33-28(23-38(36-33)29-15-9-5-10-16-29)22-31-34(26-13-7-4-8-14-26)37-39(35(31)40)30-17-11-6-12-18-30/h4-24H,1-3H3/b31-22-InChIKey
CBHKSQZMUBUFSJ-VAMRJTSQSA-NSynonyms
(4Z)4((3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)25DIPHENYLPYRAZOL3ONE
(E)4((3(4isopropoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)13diphenyl1Hpyrazol5(4H)one
CC(Oc1ccc(cc1C)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1)C
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)OC(C)C
InChI=1SC35H30N4O2c124(2)4132201927(2125(32)3)3328(2338(3633)291595101629)223134(26137481426)3739(35(31)40)3017116121830h424H13H3b3122
MFCD03461821
ZINC000097946148
ZINC97946148
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