[4-(4-cyanophenyl)phenyl] 5-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 5-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 5-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxylate CAS Name: 5-(1-ethyl-2-benzimidazolyl)-2-thiophenecarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 5-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxylate Traditional Name: 5-(1-ethylbenzimidazol-2-yl)thiophene-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C27H19N3O2S MolecularWeight: 449.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C3=CC=C(S3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C3=CC=C(S3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H19N3O2S/c1-2-30-23-6-4-3-5-22(23)29-26(30)24-15-16-25(33-24)27(31)32-21-13-11-20(12-14-21)19-9-7-18(17-28)8-10-19/h3-16H,2H2,1H3