Vitas-M small molecule compound
(4Z)-4-{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]methylidene}-5-methyl-2-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK394173
SMILES CCn1nc(c(c1C)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)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 C28H35N5O MW 457.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N5O/c1-5-32-19(4)26(18(3)30-32)29-16-25-17(2)31-33(27(25)34)24-8-6-23(7-9-24)28-13-20-10-21(14-28)12-22(11-20)15-28/h6-9,16,20-22,29H,5,10-15H2,1-4H3/b25-16-InChIKey
ZSJMWKQPBFWGBY-XYGWBWBKSA-NSynonyms
(4Z)2(4(1adamantyl)phenyl)4(((1ethyl35dimethylpyrazol4yl)amino)methylidene)5methylpyrazol3one
(4Z)4(((1ethyl35dimethyl1Hpyrazol4yl)amino)methylidene)5methyl2(4(tricyclo(3311~37~)dec1yl)phenyl)24dihydro3Hpyrazol3one
1(4ADAMANTANYLPHENYL)4(((1ETHYL35DIMETHYLPYRAZOL4YL)AMINO)METHYLENE)3METHYL12DIAZOLIN5ONE
CCN1C(=C(C(=N1)C)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C)C
CCn1nc(c(c1C)NC=C1C(=NN(C1=O)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)C)C
InChI=1SC28H35N5Oc153219(4)26(18(3)3032)29162517(2)3133(27(25)34)248623(7924)2813201021(1428)1222(1120)1528h6916202229H51015H214H3b2516
MFCD07589177
ZINC000008721678
ZINC08721678
ZINC8721678
Check stock
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Check stock on Vitas-MAvailable files
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