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

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-(3-iodo-4-methylphenyl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-(3-iodo-4-methylphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C16H14IN3O2S MolecularWeight: 439.27073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=NC(=NO2)C3=CSC=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=NC(=NO2)C3=CSC=C3)I

InChI

InChI=1S/C16H14IN3O2S/c1-10-2-3-12(8-13(10)17)18-14(21)4-5-15-19-16(20-22-15)11-6-7-23-9-11/h2-3,6-9H,4-5H2,1H3,(H,18,21)