Vitas-M small molecule compound
6,8-difluoro-1-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Catalog ID
STL542818
SMILES Fc1cc(F)c2c(c1)c(=O)c(cn2C)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 C21H25F2N3O2 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25F2N3O2/c1-25-12-16(20(27)15-9-14(22)10-17(23)19(15)25)21(28)24-11-13-5-4-8-26-7-3-2-6-18(13)26/h9-10,12-13,18H,2-8,11H2,1H3,(H,24,28)/t13-,18+/m0/s1InChIKey
IJKUDPCBRUPDOU-SCLBCKFNSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)68difluoro1methyl4oxoquinoline3carboxamide
68difluoro1methylN(((1S9aR)octahydro1Hquinolizin1yl)methyl)4oxo14dihydroquinoline3carboxamide
68difluoro1methylN((1S9aR)octahydro2Hquinolizin1ylmethyl)4oxo14dihydroquinoline3carboxamide
91637566
Fc1cc(F)c2c(c1)c(=O)c(cn2C)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC21H25F2N3O2c1251216(20(27)15914(22)1017(23)19(15)25)21(28)24111354826732618(13)26h910121318H2811H21H3(H2428)t1318+m0s1
ZINC000217766883
ZINC217766883
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