4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-p-anisyl-1H-1,2,4-triazole-5-thione Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3C(=NNC3=S)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3C(=NNC3=S)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H22N6OS/c1-15-20(16(2)27(26-15)18-7-5-4-6-8-18)14-23-28-21(24-25-22(28)30)13-17-9-11-19(29-3)12-10-17/h4-12,14H,13H2,1-3H3,(H,25,30)