Vitas-M small molecule compound
N-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-5-(2-phenylethyl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-4-carboxamide
Catalog ID
STL547644
SMILES CN(C(=O)c1nc(sc1CCc1ccccc1)n1cccc1)C[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 C27H34N4OS MW 462.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4OS/c1-29(20-22-12-9-19-30-16-6-5-13-23(22)30)26(32)25-24(15-14-21-10-3-2-4-11-21)33-27(28-25)31-17-7-8-18-31/h2-4,7-8,10-11,17-18,22-23H,5-6,9,12-16,19-20H2,1H3/t22-,23+/m0/s1InChIKey
MCGSDYVLVJDIDT-XZOQPEGZSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)~(N)methyl5(2phenylethyl)2pyrrol1yl13thiazole4carboxamide
121541659
CN(C(=O)c1nc(sc1CCc1ccccc1)n1cccc1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC27H34N4OSc129(2022129193016651323(22)30)26(32)2524(151421103241121)3327(2825)3117781831h2478101117182223H56912161920H21H3t2223+m0s1
NMETHYLN(((1S9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)5PHENETHYL2(1HPYRROL1YL)THIAZOLE4CARBOXAMIDE
NmethylN((1S9aR)octahydro2Hquinolizin1ylmethyl)5(2phenylethyl)2(1Hpyrrol1yl)13thiazole4carboxamide
ZINC000263585756
ZINC263585756
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