(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid [5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NN=C(O2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NN=C(O2)C3=CC=CS3

InChI

InChI=1S/C18H16N2O4S/c1-12-4-6-13(7-5-12)14(21)8-9-17(22)23-11-16-19-20-18(24-16)15-3-2-10-25-15/h2-7,10H,8-9,11H2,1H3