5-(phenoxymethyl)-4-[(Z)-(3-phenoxyphenyl)methylideneamino]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(phenoxymethyl)-4-[(Z)-(3-phenoxyphenyl)methylideneamino]-1,2,4-triazole-3-thiolate Openeye Name: 5-(phenoxymethyl)-4-[(Z)-(3-phenoxyphenyl)methyleneamino]-1,2,4-triazole-3-thiolate CAS Name: 5-(phenoxymethyl)-4-[(Z)-(3-phenoxyphenyl)methylideneamino]-1,2,4-triazole-3-thiolate IUPAC Name: 5-(phenoxymethyl)-4-[(Z)-(3-phenoxyphenyl)methylideneamino]-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-(3-phenoxybenzylidene)amino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate Formula: C22H17N4O2S- MolecularWeight: 401.46098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NN=C(N2N=CC3=CC(=CC=C3)OC4=CC=CC=C4)[S-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NN=C(N2/N=C\C3=CC(=CC=C3)OC4=CC=CC=C4)[S-]

InChI

InChI=1S/C22H18N4O2S/c29-22-25-24-21(16-27-18-9-3-1-4-10-18)26(22)23-15-17-8-7-13-20(14-17)28-19-11-5-2-6-12-19/h1-15H,16H2,(H,25,29)/p-1/b23-15-