Vitas-M small molecule compound

6-chloro-N-(2-{[(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl]sulfanyl}pyridin-3-yl)pyridine-3-carboxamide

Catalog ID
STL548731
SMILES Clc1ccc(cn1)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 C21H25ClN4OS MW 416.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4OS/c22-19-9-8-15(13-24-19)20(27)25-17-6-3-10-23-21(17)28-14-16-5-4-12-26-11-2-1-7-18(16)26/h3,6,8-10,13,16,18H,1-2,4-5,7,11-12,14H2,(H,25,27)/t16-,18+/m0/s1
InChIKey
ZYPPKRBFIBQRCF-FUHWJXTLSA-N
Synonyms

~(N)(2(((1~(R)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylsulfanyl)pyridin3yl)6chloropyridine3carboxamide
110206964
6CHLORON(2((((1R9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)THIO)PYRIDIN3YL)NICOTINAMIDE
6chloroN(2(((1R9aR)octahydro2Hquinolizin1ylmethyl)sulfanyl)pyridin3yl)pyridine3carboxamide
Clc1ccc(cn1)C(=O)Nc1cccnc1SC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC21H25ClN4OSc22199815(132419)20(27)251763102321(17)2814165412261121718(16)26h36810131618H12457111214H2(H2527)t1618+m0s1
ZINC000253415196
ZINC253415196

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Available files

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