[4-(4-cyanophenyl)phenyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-thiophenecarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H14N2O2S2 MolecularWeight: 438.52086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H14N2O2S2/c26-15-16-5-7-17(8-6-16)18-9-11-19(12-10-18)29-25(28)23-14-13-22(30-23)24-27-20-3-1-2-4-21(20)31-24/h1-14H