4-(3-methoxyphenyl)-5-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(3-methoxyphenyl)-5-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1,2,4-triazole-3-thiolate Openeye Name: 5-[3-[(4-isopropylphenoxy)methyl]phenyl]-4-(3-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(3-methoxyphenyl)-5-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-methoxyphenyl)-5-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1,2,4-triazole-3-thiolate Traditional Name: 5-[3-[(4-isopropylphenoxy)methyl]phenyl]-4-(3-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C25H24N3O2S- MolecularWeight: 430.54196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C3=NN=C(N3C4=CC(=CC=C4)OC)[S-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C3=NN=C(N3C4=CC(=CC=C4)OC)[S-]

InChI

InChI=1S/C25H25N3O2S/c1-17(2)19-10-12-22(13-11-19)30-16-18-6-4-7-20(14-18)24-26-27-25(31)28(24)21-8-5-9-23(15-21)29-3/h4-15,17H,16H2,1-3H3,(H,27,31)/p-1