N-(3-iodanyl-4-methyl-phenyl)-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanamide CAS Name: N-(3-iodo-4-methylphenyl)-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide IUPAC Name: N-(3-iodo-4-methylphenyl)-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butyramide Formula: C17H16IN3O2S MolecularWeight: 453.29731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3)I

InChI

InChI=1S/C17H16IN3O2S/c1-11-7-8-12(10-13(11)18)19-15(22)5-2-6-16-20-17(21-23-16)14-4-3-9-24-14/h3-4,7-10H,2,5-6H2,1H3,(H,19,22)