Vitas-M small molecule compound
1-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Catalog ID
STL359564
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Cl)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 C22H25ClN4O2 MW 412.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN4O2/c1-13-19(20(28)27(26-13)18-4-2-17(23)3-5-18)12-24-21(29)25-22-9-14-6-15(10-22)8-16(7-14)11-22/h2-5,12,14-16H,6-11H2,1H3,(H2,24,25,29)/b19-12-InChIKey
DSZPBXOSGDMVHS-UNOMPAQXSA-NSynonyms
1((Z)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)3tricyclo(3311~37~)dec1ylurea
1(1ADAMANTYL)3((Z)(1(4CHLOROPHENYL)3METHYL5OXOPYRAZOL4YLIDENE)METHYL)UREA
CC1=NN(C(=O)C1=CNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)Cl
InChI=1SC22H25ClN4O2c11319(20(28)27(2613)184217(23)3518)122421(29)2522914615(1022)816(714)1122h25121416H611H21H3(H2242529)b1912
NADAMANTANYL(((1(4CHLOROPHENYL)3METHYL5OXO(12DIAZOLIN4YLIDENE))METHYL)AMINO)CARBOXAMIDE
O=C(NC12CC3CC(C2)CC(C1)C3)NC=C1C(=NN(C1=O)c1ccc(cc1)Cl)C
ZINC000016160634
ZINC16160634
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