4-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl thiophene-2-carboxylate

Systemtic Name: 4-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl thiophene-2-carboxylate Openeye Name: 4-[[5-(2-naphthyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid 4-[[5-(2-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester IUPAC Name: 4-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid 4-[[5-(2-naphthyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester Formula: C21H14N2O3S2 MolecularWeight: 406.47746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SCC#CCOC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SCC#CCOC(=O)C4=CC=CS4

InChI

InChI=1S/C21H14N2O3S2/c24-20(18-8-5-13-27-18)25-11-3-4-12-28-21-23-22-19(26-21)17-10-9-15-6-1-2-7-16(15)14-17/h1-2,5-10,13-14H,11-12H2