4-[(Z)-[4-(diphenylamino)phenyl]methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-[4-(diphenylamino)phenyl]methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-[4-(N-phenylanilino)phenyl]methyleneamino]-5-(2-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-[4-(N-phenylanilino)phenyl]methylideneamino]-5-(2-pyridinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-[4-(N-phenylanilino)phenyl]methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-[4-(N-phenylanilino)benzylidene]amino]-5-(2-pyridyl)-1,2,4-triazole-3-thiolate Formula: C26H19N6S- MolecularWeight: 447.53426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C=NN4C(=NN=C4[S-])C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)/C=N\N4C(=NN=C4[S-])C5=CC=CC=N5

InChI

InChI=1S/C26H20N6S/c33-26-30-29-25(24-13-7-8-18-27-24)32(26)28-19-20-14-16-23(17-15-20)31(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-19H,(H,30,33)/p-1/b28-19-