3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-nitrophenyl)-4-(4-phenoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=NNC3=S)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=NNC3=S)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O3S/c25-24(26)16-6-4-5-14(13-16)19-21-22-20(28)23(19)15-9-11-18(12-10-15)27-17-7-2-1-3-8-17/h1-13H,(H,22,28)