4-(3,5-dimethoxyphenyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3,5-dimethoxyphenyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3,5-dimethoxyphenyl)-3-[(2-phenylthiazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(3,5-dimethoxyphenyl)-3-[(2-phenyl-4-thiazolyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3,5-dimethoxyphenyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3,5-dimethoxyphenyl)-3-[(2-phenylthiazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=NNC2=S)CC3=CSC(=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=NNC2=S)CC3=CSC(=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C20H18N4O2S2/c1-25-16-9-15(10-17(11-16)26-2)24-18(22-23-20(24)27)8-14-12-28-19(21-14)13-6-4-3-5-7-13/h3-7,9-12H,8H2,1-2H3,(H,23,27)