Vitas-M small molecule compound
1-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-2-oxo-1,2-dihydroquinoline-4-carboxamide
Catalog ID
STL539661
SMILES O=C(c1cc(=O)n(c2c1cccc2)C)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 C21H27N3O2 MW 353.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2/c1-23-19-10-3-2-8-16(19)17(13-20(23)25)21(26)22-14-15-7-6-12-24-11-5-4-9-18(15)24/h2-3,8,10,13,15,18H,4-7,9,11-12,14H2,1H3,(H,22,26)/t15-,18+/m0/s1InChIKey
XOTUBFUVKJJDSG-MAUKXSAKSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)1methyl2oxoquinoline4carboxamide
1methylN(((1S9aR)octahydro1Hquinolizin1yl)methyl)2oxo12dihydroquinoline4carboxamide
1methylN((1S9aR)octahydro2Hquinolizin1ylmethyl)2oxo12dihydroquinoline4carboxamide
71754410
InChI=1SC21H27N3O2c123191032816(19)17(1320(23)25)21(26)2214157612241154918(15)24h23810131518H479111214H21H3(H2226)t1518+m0s1
O=C(c1cc(=O)n(c2c1cccc2)C)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000079193962
ZINC79193962
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