[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-acetamido-4,5-dimethyl-3-thiophenecarboxylic acid [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-acetamido-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-acetamido-4,5-dimethyl-thiophene-3-carboxylic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C)NC(=O)C)C

InChI

InChI=1S/C21H23N3O4S/c1-11(2)15-6-8-16(9-7-15)19-23-17(28-24-19)10-27-21(26)18-12(3)13(4)29-20(18)22-14(5)25/h6-9,11H,10H2,1-5H3,(H,22,25)