Vitas-M small molecule compound

N-{(1Z)-1-[(1S,5R)-6,6-dimethyl-3-oxobicyclo[3.1.0]hex-2-ylidene]ethyl}-3-fluorobenzamide

Catalog ID
STK538399
SMILES Fc1cccc(c1)C(=O)N/C(=C/1\C(=O)C[C@@H]2[C@H]1C2(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 C17H18FNO2 MW 287.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18FNO2/c1-9(14-13(20)8-12-15(14)17(12,2)3)19-16(21)10-5-4-6-11(18)7-10/h4-7,12,15H,8H2,1-3H3,(H,19,21)/b14-9+/t12-,15-/m1/s1
InChIKey
PZAHHNJMZSBCEU-BZOBAROVSA-N
Synonyms
1164509-52-7
1164509527
CC(=C1C2C(C2(C)C)CC1=O)NC(=O)C3=CC(=CC=C3)F
Fc1cccc(c1)C(=O)NC(=C1C(=O)C(C@@H)2(C@H)1C2(C)C)C
InChI=1SC17H18FNO2c19(1413(20)81215(14)17(122)3)1916(21)1054611(18)710h471215H8H213H3(H1921)b149+t1215m1s1
MFCD18241706
N((1Z)1((1R5S)66DIMETHYL3OXO4BICYCLO(310)HEXANYLIDENE)ETHYL)3FLUOROBENZAMIDE
N((1Z)1((1S5R)66dimethyl3oxo2bicyclo(310)hexanylidene)ethyl)3fluorobenzamide
N((1Z)1((1S5R)66dimethyl3oxobicyclo(310)hex2ylidene)ethyl)3fluorobenzamide
N((Z)1((1S5R)66dimethyl3oxobicyclo(310)hexan2ylidene)ethyl)3fluorobenzamide
N(1((1S5R)66DIMETHYL3OXOBICYCLO(310)HEX(2Z)YLIDENE)ETHYL)3FLUOROBENZAMIDE
ZINC000004860616
ZINC04860616
ZINC4860616

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Available files

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