N-(4-butan-2-ylphenyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide

Systemtic Name: N-(4-butan-2-ylphenyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide Openeye Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-N-(4-sec-butylphenyl)benzamide CAS Name: N-(4-butan-2-ylphenyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide Traditional Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]-N-(4-sec-butylphenyl)benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

InChI

InChI=1S/C21H23N3O2S/c1-4-14(2)16-9-11-17(12-10-16)23-21(25)18-7-5-6-8-19(18)27-13-20-22-15(3)24-26-20/h5-12,14H,4,13H2,1-3H3,(H,23,25)