Vitas-M small molecule compound

(2E)-2-{1-[4-(4-fluorophenyl)piperazin-1-yl]ethylidene}-6,6-dimethylbicyclo[3.1.0]hexan-3-one

Catalog ID
STL343103
SMILES Fc1ccc(cc1)N1CCN(CC1)/C(=C\1/C(=O)CC2C1C2(C)C)/C

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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 C20H25FN2O MW 328.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25FN2O/c1-13(18-17(24)12-16-19(18)20(16,2)3)22-8-10-23(11-9-22)15-6-4-14(21)5-7-15/h4-7,16,19H,8-12H2,1-3H3/b18-13-
InChIKey
FHRJLIBVKIONQH-AQTBWJFISA-N
Synonyms

(1S5RE)2(1(4(4fluorophenyl)piperazin1yl)ethylidene)66dimethylbicyclo(310)hexan3one
(2E)2(1(4(4fluorophenyl)piperazin1yl)ethylidene)66dimethylbicyclo(310)hexan3one
CC(=C1C2C(C2(C)C)CC1=O)N3CCN(CC3)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1CCN(CC1)C(=C1C(=O)C(C@@H)2(C@H)1C2(C)C)C
Fc1ccc(cc1)N1CCN(CC1)C(=C1C(=O)CC2C1C2(C)C)C
InChI=1SC20H25FN2Oc113(1817(24)121619(18)20(162)3)2281023(11922)156414(21)5715h471619H812H213H3b1813
MFCD28032493
ZINC000000536742
ZINC000105922714

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Available files

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