Anodyne

test
Nepicastat
Nepicastat
Salts
[]
Nepicastat hydrochloride
Nepicastat hydrochloride
Molecular structure via molpic
Conformer structure via 3Dmol.js
Molecular formulaC14H15F2N3S
Molecular mass295.35 g/mol
Predicted LogP1.4
Chiralityabsolute
Identifiers
[]
IUPAC name4-(aminomethyl)-3-[(2S)-5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-1H-imidazole-2-thione
SMILESC1CC2=C(C[C@H]1N3C(=CNC3=S)CN)C=C(C=C2F)F
InChIInChI=1S/C14H15F2N3S/c15-9-3-8-4-10(1-2-12(8)13(16)5-9)19-11(6-17)7-18-14(19)20/h3,5,7,10H,1-2,4,6,17H2,(H,18,20)/t10-/m0/s1
InChIKeyYZZVIKDAOTXDEB-JTQLQIEISA-N
Dosing

Nepicastat

Nepicastat (also known as nepicastatum, SYN-117, 5-(Aminomethyl)-1-((S)-5,7-difluoro-1,2,3,4-tetrahydro-2-naphthyl)-4-imidazoline-2-thione, Rs-25560-197, (S)-5-aminomethyl-1-(5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-1,3-dihydroimidazole-2-thione, (S)-5-(aminomethyl)-1-(5,7-difluoro-1,2,3,4-tetrahydro-2-naphthalenyl)-1,3-dihydro-2h-imidazole-2-thione, 5-(aminomethyl)-1-[(2S)-5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-1,3-dihydro-2H-imidazole-2-thione, 5-(aminomethyl)-1-[(2S)-5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-3H-imidazole-2-thione, 5-(aminomethyl)-1-((2S)-5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-1,3-dihydro-2H-imidazole-2-thione or 5-(aminomethyl)-1-((2S)-5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-2,3-dihydro-1H-imidazole-2-thione) is a substance of the amphetamine class.

Chemistry

Nepicastat is typically found in the form of its hydrochloride salt.

Stereochemistry

Nepicastat is a absolute mixture

See also