Vitas-M small molecule compound
4-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-4-oxobutanamide
Catalog ID
STL535553
SMILES O=C(CCC(=O)N1CCC(CC1)c1noc2c1ccc(c2)F)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 C26H35FN4O3 MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35FN4O3/c27-20-6-7-21-23(16-20)34-29-26(21)18-10-14-31(15-11-18)25(33)9-8-24(32)28-17-19-4-3-13-30-12-2-1-5-22(19)30/h6-7,16,18-19,22H,1-5,8-15,17H2,(H,28,32)/t19-,22+/m0/s1InChIKey
AKDVPGIPGISLHK-SIKLNZKXSA-NSynonyms
1212435-50-1~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)4(4(6fluoro12benzoxazol3yl)piperidin1yl)4oxobutanamide
1212435501
29147968
4(4(6fluoro12benzoxazol3yl)piperidin1yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)4oxobutanamide
4(4(6fluorobenzo(d)isoxazol3yl)piperidin1yl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)4oxobutanamide
InChI=1SC26H35FN4O3c2720672123(1620)342926(21)18101431(151118)25(33)9824(32)2817194313301221522(19)30h6716181922H1581517H2(H2832)t1922+m0s1
O=C(CCC(=O)N1CCC(CC1)c1noc2c1ccc(c2)F)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000020762436
ZINC20762436
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