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(2S)-2-(1-adamantylsulfanyl)-N-[(4-fluorophenyl)methyl]propanamide

(2S)-2-(1-adamantylsulfanyl)-N-[(4-fluorophenyl)methyl]propanamide

Systemtic Name:(2S)-2-(1-adamantylsulfanyl)-N-[(4-fluorophenyl)methyl]propanamide
Openeye Name:(2S)-2-(1-adamantylsulfanyl)-N-[(4-fluorophenyl)methyl]propanamide
CAS Name:(2S)-2-(1-adamantylthio)-N-[(4-fluorophenyl)methyl]propanamide
IUPAC Name:(2S)-2-(1-adamantylsulfanyl)-N-[(4-fluorophenyl)methyl]propanamide
Traditional Name:(2S)-2-(1-adamantylthio)-N-(4-fluorobenzyl)propionamide
Formula: C20H26FNOS
MolecularWeight: 347.489943
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)F)SC23CC4CC(C2)CC(C4)C3


Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)F)SC23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C20H26FNOS/c1-13(19(23)22-12-14-2-4-18(21)5-3-14)24-20-9-15-6-16(10-20)8-17(7-15)11-20/h2-5,13,15-17H,6-12H2,1H3,(H,22,23)/t13-,15?,16?,17?,20?/m0/s1


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