[4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxylate

Systemtic Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxylate Openeye Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxylate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thiophenecarboxylic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester IUPAC Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxylate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxylic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester Formula: C22H17N3O5S2 MolecularWeight: 467.51748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)OC4=CC=C(C=C4)C5=NN=CO5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)OC4=CC=C(C=C4)C5=NN=CO5

InChI

InChI=1S/C22H17N3O5S2/c26-22(30-18-7-5-16(6-8-18)21-24-23-14-29-21)20-19(10-12-31-20)32(27,28)25-11-9-15-3-1-2-4-17(15)13-25/h1-8,10,12,14H,9,11,13H2