Vitas-M small molecule compound
3,4-dimethoxy-N-(2-{[(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl]sulfanyl}pyridin-3-yl)benzamide
Catalog ID
STL547750
SMILES COc1cc(ccc1OC)C(=O)Nc1cccnc1SC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C24H31N3O3S MW 441.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O3S/c1-29-21-11-10-17(15-22(21)30-2)23(28)26-19-8-5-12-25-24(19)31-16-18-7-6-14-27-13-4-3-9-20(18)27/h5,8,10-12,15,18,20H,3-4,6-7,9,13-14,16H2,1-2H3,(H,26,28)/t18-,20+/m0/s1InChIKey
KSFQUUGZZMFUQK-AZUAARDMSA-NSynonyms
~(N)(2(((1~(R)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylsulfanyl)pyridin3yl)34dimethoxybenzamide
110206005
34DIMETHOXYN(2((((1R9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)THIO)PYRIDIN3YL)BENZAMIDE
34dimethoxyN(2(((1R9aR)octahydro2Hquinolizin1ylmethyl)sulfanyl)pyridin3yl)benzamide
COc1cc(ccc1OC)C(=O)Nc1cccnc1SC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC24H31N3O3Sc12921111017(1522(21)302)23(28)261985122524(19)3116187614271343920(18)27h581012151820H34679131416H212H3(H2628)t1820+m0s1
ZINC000253408434
ZINC253408434
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