Vitas-M small molecule compound
4-{[(3-chloro-6-oxopyridazin-1(6H)-yl)acetyl]amino}-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]benzamide
Catalog ID
STL539621
SMILES O=C(Cn1nc(Cl)ccc1=O)Nc1ccc(cc1)C(=O)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 C23H28ClN5O3 MW 457.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28ClN5O3/c24-20-10-11-22(31)29(27-20)15-21(30)26-18-8-6-16(7-9-18)23(32)25-14-17-4-3-13-28-12-2-1-5-19(17)28/h6-11,17,19H,1-5,12-15H2,(H,25,32)(H,26,30)/t17-,19+/m0/s1InChIKey
LOPISFWNHXCHMX-PKOBYXMFSA-NSynonyms
1435901-44-2~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)4((2(3chloro6oxopyridazin1yl)acetyl)amino)benzamide
1435901442
4(((3chloro6oxopyridazin1(6H)yl)acetyl)amino)N((1S9aR)octahydro2Hquinolizin1ylmethyl)benzamide
4(2(3chloro6oxopyridazin1(6H)yl)acetamido)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)benzamide
71754970
InChI=1SC23H28ClN5O3c2420101122(31)29(2720)1521(30)26188616(7918)23(32)2514174313281221519(17)28h6111719H151215H2(H2532)(H2630)t1719+m0s1
O=C(Cn1nc(Cl)ccc1=O)Nc1ccc(cc1)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000085878000
ZINC85878000
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