N-(3-methylsulfanylphenyl)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide Openeye Name: 3-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methylsulfanylphenyl)propanamide CAS Name: N-[3-(methylthio)phenyl]-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-(3-methylsulfanylphenyl)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide Traditional Name: N-[3-(methylthio)phenyl]-3-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H23N3O2S/c1-14(2)15-7-9-16(10-8-15)21-23-20(26-24-21)12-11-19(25)22-17-5-4-6-18(13-17)27-3/h4-10,13-14H,11-12H2,1-3H3,(H,22,25)