Vitas-M small molecule compound
ethyl 1-methyl-3-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]carbamoyl}-1H-pyrazole-5-carboxylate
Catalog ID
STK304757
SMILES CCOC(=O)c1cc(nn1C)C(=O)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3
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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 C21H27N5O3 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3/c1-3-29-20(28)17-9-16(23-25(17)2)19(27)22-18-4-5-26(24-18)21-10-13-6-14(11-21)8-15(7-13)12-21/h4-5,9,13-15H,3,6-8,10-12H2,1-2H3,(H,22,24,27)InChIKey
CBLAWBSSDFXMCC-UHFFFAOYSA-NSynonyms
1005553-16-11005553161
CCOC(=O)C1=CC(=NN1C)C(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4
ethyl1methyl3((1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)carbamoyl)1Hpyrazole5carboxylate
ETHYL5((1(1ADAMANTYL)PYRAZOL3YL)CARBAMOYL)2METHYLPYRAZOLE3CARBOXYLATE
InChI=1SC21H27N5O3c132920(28)17916(2325(17)2)19(27)22184526(2418)211013614(1121)815(713)1221h4591315H3681012H212H3(H222427)
MFCD04051492
ZINC000006402129
ZINC06402129
ZINC6402129
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