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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NNC(=S)N2N=CC3=C(N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1C2=NNC(=S)N2N=CC3=C(N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C22H22N6OS/c1-4-29-20-13-9-8-12-18(20)21-24-25-22(30)28(21)23-14-19-15(2)26-27(16(19)3)17-10-6-5-7-11-17/h5-14H,4H2,1-3H3,(H,25,30)