Vitas-M small molecule compound
(4Z)-4-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK823108
SMILES CC(c1ccc(c(c1)c1nn(cc1/C=C/1\C(=O)N(N=C1c1ccccc1)c1ccccc1)c1ccccc1)C)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 C35H30N4O MW 522.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O/c1-24(2)27-20-19-25(3)31(21-27)34-28(23-38(36-34)29-15-9-5-10-16-29)22-32-33(26-13-7-4-8-14-26)37-39(35(32)40)30-17-11-6-12-18-30/h4-24H,1-3H3/b32-22-InChIKey
VDWOXSJWSIUFHZ-JDCMOKTRSA-NSynonyms
(4Z)4((3(2methyl5(propan2yl)phenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(2methyl5propan2ylphenyl)1phenylpyrazol4yl)methylidene)25diphenylpyrazol3one
CC(c1ccc(c(c1)c1nn(cc1C=C1C(=O)N(N=C1c1ccccc1)c1ccccc1)c1ccccc1)C)C
CC1=C(C=C(C=C1)C(C)C)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC35H30N4Oc124(2)27201925(3)31(2127)3428(2338(3634)291595101629)223233(26137481426)3739(35(32)40)3017116121830h424H13H3b3222
MFCD03463653
ZINC000027018516
ZINC27018516
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