3-phenyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-phenyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-phenyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-phenyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-phenyl-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-phenyl-4-[(2,3,4-trimethoxybenzyl)amino]-1H-1,2,4-triazole-5-thione Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNN2C(=NNC2=S)C3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNN2C(=NNC2=S)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C18H20N4O3S/c1-23-14-10-9-13(15(24-2)16(14)25-3)11-19-22-17(20-21-18(22)26)12-7-5-4-6-8-12/h4-10,19H,11H2,1-3H3,(H,21,26)