3-(3-ethoxyphenyl)-4-[(E)-(3-phenoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(3-ethoxyphenyl)-4-[(E)-(3-phenoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-ethoxyphenyl)-4-[(E)-(3-phenoxyphenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-ethoxyphenyl)-4-[(E)-(3-phenoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-ethoxyphenyl)-4-[(E)-(3-phenoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-m-phenetyl-4-[(E)-(3-phenoxybenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C23H20N4O2S MolecularWeight: 416.4955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NNC(=S)N2/N=C/C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2S/c1-2-28-20-12-7-9-18(15-20)22-25-26-23(30)27(22)24-16-17-8-6-13-21(14-17)29-19-10-4-3-5-11-19/h3-16H,2H2,1H3,(H,26,30)/b24-16+