N-(2,6-dimethylphenyl)-4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylthio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]butyramide Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C19H21N3O2S2/c1-13-6-3-7-14(2)18(13)20-16(23)9-5-10-25-12-17-21-19(22-24-17)15-8-4-11-26-15/h3-4,6-8,11H,5,9-10,12H2,1-2H3,(H,20,23)