(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C19H14N2O3S MolecularWeight: 350.39106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C19H14N2O3S/c1-12-14-9-5-6-10-15(14)25-17(12)19(22)23-11-16-20-18(21-24-16)13-7-3-2-4-8-13/h2-10H,11H2,1H3