N-[5-[(4-ethylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[5-[(4-ethylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]adamantane-1-carboxamide Openeye Name: N-[5-[(4-ethylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]adamantane-1-carboxamide CAS Name: N-[5-[[4-(ethylthio)phenyl]methyl]-1,3,4-oxadiazol-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[5-[(4-ethylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]adamantane-1-carboxamide Traditional Name: N-[5-[4-(ethylthio)benzyl]-1,3,4-oxadiazol-2-yl]adamantane-1-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCSC1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-2-28-18-5-3-14(4-6-18)10-19-24-25-21(27-19)23-20(26)22-11-15-7-16(12-22)9-17(8-15)13-22/h3-6,15-17H,2,7-13H2,1H3,(H,23,25,26)