Vitas-M small molecule compound
1'-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-4,5,6,7,8,8a-hexahydro-3aH-spiro[cyclohepta[d][1,3]dioxole-2,3'-indol]-2'(1'H)-one
Catalog ID
STK780985
SMILES O=C1N(CN2CCc3c(C2)cccc3)c2c(C31OC1C(O3)CCCCC1)cccc2
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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 C25H28N2O3 MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O3/c28-24-25(29-22-12-2-1-3-13-23(22)30-25)20-10-6-7-11-21(20)27(24)17-26-15-14-18-8-4-5-9-19(18)16-26/h4-11,22-23H,1-3,12-17H2InChIKey
BVZPIBXMSLWZEV-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2ylmethyl)spiro(456788ahexahydro3aHcyclohepta(d)(13)dioxole23indole)2one
1(34dihydroisoquinolin2(1H)ylmethyl)456788ahexahydro3aHspiro(cyclohepta(d)(13)dioxole23indol)2(1H)one
C1CCC2C(CC1)OC3(O2)C4=CC=CC=C4N(C3=O)CN5CCC6=CC=CC=C6C5
InChI=1SC25H28N2O3c282425(2922122131323(22)3025)2010671121(20)27(24)1726151418845919(18)1626h4112223H131217H2
MFCD06014118
ZINC000019874401
ZINC000252430648
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Check stock on Vitas-MAvailable files
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