Vitas-M small molecule compound
1,3-bis(4-ethoxyphenyl)-2-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
Catalog ID
STL264409
SMILES CCOc1ccc(cc1)[n+]1c2CCCCCn2c(c1C)c1ccc(cc1)OCC
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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 C25H31N2O2 MW 391.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N2O2/c1-4-28-22-14-10-20(11-15-22)25-19(3)27(24-9-7-6-8-18-26(24)25)21-12-16-23(17-13-21)29-5-2/h10-17H,4-9,18H2,1-3H3/q+1InChIKey
PZLSVBQHOMDHFI-UHFFFAOYSA-NSynonyms
(O)(Cl)(=O)(=O)=OCCOc1ccc(cc1)(n+)1c2CCCCCn2c(c1C)c1ccc(cc1)OCC
13bis(4ethoxyphenyl)2methyl6789tetrahydro5Himidazo(12a)azepin1ium
13bis(4ethoxyphenyl)2methyl6789tetrahydro5Himidazo(12a)azepin1iumperchlorate
13bis(4ethoxyphenyl)2methyl6789tetrahydro5Himidazo(12a)azepin4ium
4ETHOXY1(1(4ETHOXYPHENYL)2METHYL(5H6H7H8H9HIMIDAZO(12A)AZAPERHYDROEPIN3YL))BENZENE
CCOC1=CC=C(C=C1)C2=C(N(C3=(N+)2CCCCC3)C4=CC=C(C=C4)OCC)C
CCOc1ccc(cc1)(n+)1c2CCCCCn2c(c1C)c1ccc(cc1)OCC
InChI=1SC25H31N2O2c142822141020(111522)2519(3)27(2497681826(24)25)21121623(171321)2952h1017H4918H213H3q+1
ZINC000013686361
ZINC13686361
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