Vitas-M small molecule compound
(4Z)-4-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK798861
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)c1ccccc1)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 C37H34N4O2 MW 566.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H34N4O2/c1-2-3-4-14-25-43-33-23-21-29(22-24-33)35-30(27-40(38-35)31-17-10-6-11-18-31)26-34-36(28-15-8-5-9-16-28)39-41(37(34)42)32-19-12-7-13-20-32/h5-13,15-24,26-27H,2-4,14,25H2,1H3/b34-26-InChIKey
OUSFNLYACCSTNG-CLIDGEQKSA-NSynonyms
(4Z)4((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)25DIPHENYLPYRAZOL3ONE
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1
InChI=1SC37H34N4O2c123414254333232129(222433)3530(2740(3835)3117106111831)263436(28158591628)3941(37(34)42)3219127132032h51315242627H241425H21H3b3426
MFCD03462106
ZINC000097946192
ZINC97946192
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