Vitas-M small molecule compound
N-(6-{[(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl]sulfanyl}pyridin-3-yl)biphenyl-2-carboxamide
Catalog ID
STL544684
SMILES O=C(c1ccccc1c1ccccc1)Nc1ccc(nc1)SC[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 C28H31N3OS MW 457.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3OS/c32-28(25-13-5-4-12-24(25)21-9-2-1-3-10-21)30-23-15-16-27(29-19-23)33-20-22-11-8-18-31-17-7-6-14-26(22)31/h1-5,9-10,12-13,15-16,19,22,26H,6-8,11,14,17-18,20H2,(H,30,32)/t22-,26+/m0/s1InChIKey
IIIBMQKFNYJJTL-BKMJKUGQSA-NSynonyms
~(N)(6(((1~(R)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylsulfanyl)pyridin3yl)2phenylbenzamide
100003747
InChI=1SC28H31N3OSc3228(2513541224(25)2192131021)3023151627(291923)332022118183117761426(22)31h1591012131516192226H681114171820H2(H3032)t2226+m0s1
N(6((((1R9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)THIO)PYRIDIN3YL)(11BIPHENYL)2CARBOXAMIDE
N(6(((1R9aR)octahydro2Hquinolizin1ylmethyl)sulfanyl)pyridin3yl)biphenyl2carboxamide
O=C(c1ccccc1c1ccccc1)Nc1ccc(nc1)SC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000218093050
ZINC218093050
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