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

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H12N2O3S2 MolecularWeight: 356.41878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2O3S2/c1-10-12-4-2-3-5-13(12)24-15(10)17(20)21-8-14-18-16(19-22-14)11-6-7-23-9-11/h2-7,9H,8H2,1H3