Vitas-M small molecule compound
5-[2-(1,6-dimethylpyridinium-3-yl)ethyl]-2,2-dimethyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium
Catalog ID
STL552636
SMILES C[n+]1cc(ccc1C)CCn1c2ccccc2c2c1CC[N+](C2)(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 C22H29N3 MW 335.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3/c1-17-9-10-18(15-23(17)2)11-13-24-21-8-6-5-7-19(21)20-16-25(3,4)14-12-22(20)24/h5-10,15H,11-14,16H2,1-4H3/q+2InChIKey
XBJLFTXBPYLSPJ-UHFFFAOYSA-NSynonyms
5(2(16dimethylpyridin1ium3yl)ethyl)22dimethyl2345tetrahydro1Hpyrido(43b)indol2iumiodide
5(2(16dimethylpyridin1ium3yl)ethyl)22dimethyl34dihydro1~(H)pyrido(43b)indol2ium
5(2(16DIMETHYLPYRIDIN1IUM3YL)ETHYL)22DIMETHYL34DIHYDRO1HPYRIDO(43B)INDOL2IUM
5(2(16dimethylpyridinium3yl)ethyl)22dimethyl2345tetrahydro1Hpyrido(43b)indol2ium
839730
C(n+)1cc(ccc1C)CCn1c2ccccc2c2c1CC(N+)(C2)(C)C(I)(I)
InChI=1SC22H29N3c11791018(1523(17)2)11132421865719(21)201625(34)141222(20)24h51015H111416H214H3q+2
ZINC000000368168
ZINC368168
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