Vitas-M small molecule compound
2-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL320604
SMILES O=c1cc2CCCCCc2nn1CN1CC2(CC1CC(C2)(C)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 C20H31N3O MW 329.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31N3O/c1-19(2)10-16-11-20(3,12-19)13-22(16)14-23-18(24)9-15-7-5-4-6-8-17(15)21-23/h9,16H,4-8,10-14H2,1-3H3InChIKey
DZWMAWMXAMFXIX-UHFFFAOYSA-NSynonyms
1401622-45-41401622454
2(((1R5S)133trimethyl6azabicyclo(321)octan6yl)methyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2((133trimethyl6azabicyclo(321)oct6yl)methyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2((335trimethyl7azabicyclo(321)octan7yl)methyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
CC1(CC2CC(C1)(CN2CN3C(=O)C=C4CCCCCC4=N3)C)C
InChI=1SC20H31N3Oc119(2)10161120(31219)1322(16)142318(24)9157546817(15)2123h916H481014H213H3
MFCD28029588
ZINC000101363414
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