N-[2-[4-[(2R)-2-(1-adamantylsulfanyl)propanoyl]phenyl]ethyl]ethanamide

Systemtic Name: N-[2-[4-[(2R)-2-(1-adamantylsulfanyl)propanoyl]phenyl]ethyl]ethanamide Openeye Name: N-[2-[4-[(2R)-2-(1-adamantylsulfanyl)propanoyl]phenyl]ethyl]acetamide CAS Name: N-[2-[4-[(2R)-2-(1-adamantylthio)-1-oxopropyl]phenyl]ethyl]acetamide IUPAC Name: N-[2-[4-[(2R)-2-(1-adamantylsulfanyl)propanoyl]phenyl]ethyl]acetamide Traditional Name: N-[2-[4-[(2R)-2-(1-adamantylthio)propanoyl]phenyl]ethyl]acetamide Formula: C23H31NO2S MolecularWeight: 385.56274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO2S/c1-15(27-23-12-18-9-19(13-23)11-20(10-18)14-23)22(26)21-5-3-17(4-6-21)7-8-24-16(2)25/h3-6,15,18-20H,7-14H2,1-2H3,(H,24,25)/t15-,18?,19?,20?,23?/m1/s1