Vitas-M small molecule compound
N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-3-(pyrimidin-2-ylamino)benzamide
Catalog ID
STL539486
SMILES O=C(c1cccc(c1)Nc1ncccn1)NC[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 C21H27N5O MW 365.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O/c27-20(24-15-17-7-4-13-26-12-2-1-9-19(17)26)16-6-3-8-18(14-16)25-21-22-10-5-11-23-21/h3,5-6,8,10-11,14,17,19H,1-2,4,7,9,12-13,15H2,(H,24,27)(H,22,23,25)/t17-,19+/m0/s1InChIKey
KBQSCXATVVYCNF-PKOBYXMFSA-NSynonyms
1435989-41-5~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)3(pyrimidin2ylamino)benzamide
1435989415
71754468
InChI=1SC21H27N5Oc2720(2415177413261221919(17)26)1663818(1416)252122105112321h35681011141719H12479121315H2(H2427)(H222325)t1719+m0s1
N(((1S9aR)octahydro1Hquinolizin1yl)methyl)3(pyrimidin2ylamino)benzamide
N((1S9aR)octahydro2Hquinolizin1ylmethyl)3(pyrimidin2ylamino)benzamide
O=C(c1cccc(c1)Nc1ncccn1)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000085875059
ZINC85875059
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