Vitas-M small molecule compound
2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl[4-(2-methoxyphenyl)piperazin-1-yl]methanone
Catalog ID
STL407646
SMILES COc1ccccc1N1CCN(CC1)C(=O)c1[nH]nc2c1CCCCC2
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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 C20H26N4O2 MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2/c1-26-18-10-6-5-9-17(18)23-11-13-24(14-12-23)20(25)19-15-7-3-2-4-8-16(15)21-22-19/h5-6,9-10H,2-4,7-8,11-14H2,1H3,(H,21,22)InChIKey
IXFQXBMSOUSQGX-UHFFFAOYSA-NSynonyms
1574530-94-1(145678hexahydrocyclohepta(c)pyrazol3yl)(4(2methoxyphenyl)piperazin1yl)methanone
145678hexahydrocyclohepta(c)pyrazol3yl(4(2methoxyphenyl)piperazin1yl)methanone
1574530941
245678hexahydrocyclohepta(c)pyrazol3yl(4(2methoxyphenyl)piperazin1yl)methanone
COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=NNC4=C3CCCCC4
COc1ccccc1N1CCN(CC1)C(=O)c1(nH)nc2c1CCCCC2
COc1ccccc1N1CCN(CC1)C(=O)c1n(nH)c2c1CCCCC2
InChI=1SC20H26N4O2c126181065917(18)23111324(141223)20(25)19157324816(15)212219h56910H24781114H21H3(H2122)
MFCD30704843
ZINC000096231255
ZINC96231255
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