4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-benzyloxyphenyl)methyleneamino]-3-(3-isopropoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-benzoxybenzylidene)amino]-3-(3-isopropoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2/N=C/C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2S/c1-18(2)31-23-10-6-9-21(15-23)24-27-28-25(32)29(24)26-16-19-11-13-22(14-12-19)30-17-20-7-4-3-5-8-20/h3-16,18H,17H2,1-2H3,(H,28,32)/b26-16+