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(2S)-2-(1-adamantylsulfanyl)-N-phenethyl-propanamide

(2S)-2-(1-adamantylsulfanyl)-N-phenethyl-propanamide

Systemtic Name:(2S)-2-(1-adamantylsulfanyl)-N-phenethyl-propanamide
Openeye Name:(2S)-2-(1-adamantylsulfanyl)-N-phenethyl-propanamide
CAS Name:(2S)-2-(1-adamantylthio)-N-phenethylpropanamide
IUPAC Name:(2S)-2-(1-adamantylsulfanyl)-N-phenethylpropanamide
Traditional Name:(2S)-2-(1-adamantylthio)-N-phenethyl-propionamide
Formula: C21H29NOS
MolecularWeight: 343.52606
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SC23CC4CC(C2)CC(C4)C3


Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=CC=C1)SC23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C21H29NOS/c1-15(20(23)22-8-7-16-5-3-2-4-6-16)24-21-12-17-9-18(13-21)11-19(10-17)14-21/h2-6,15,17-19H,7-14H2,1H3,(H,22,23)/t15-,17?,18?,19?,21?/m0/s1


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