Vitas-M small molecule compound
2-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL320136
SMILES O=c1cc2CCCCCc2nn1CN1CCN(CC1)C/C=C/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 C23H30N4O MW 378.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O/c28-23-18-21-11-5-2-6-12-22(21)24-27(23)19-26-16-14-25(15-17-26)13-7-10-20-8-3-1-4-9-20/h1,3-4,7-10,18H,2,5-6,11-17,19H2/b10-7+InChIKey
XXULVQQDEFURFG-JXMROGBWSA-NSynonyms
1401612-74-5(E)2((4cinnamylpiperazin1yl)methyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
1401612745
2((4((2E)3phenylprop2en1yl)piperazin1yl)methyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2((4((E)3phenylprop2enyl)piperazin1yl)methyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
C1CCC2=CC(=O)N(N=C2CC1)CN3CCN(CC3)CC=CC4=CC=CC=C4
InChI=1SC23H30N4Oc28231821115261222(21)2427(23)1926161425(151726)13710208314920h13471018H256111719H2b107+
MFCD22581802
O=c1cc2CCCCCc2nn1CN1CCN(CC1)CC=Cc1ccccc1
ZINC000079464718
ZINC79464718
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