4-phenethyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-phenethyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-phenethyl-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-phenethyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-phenethyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenethyl-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C15H14N4S MolecularWeight: 282.36346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NNC2=S)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NNC2=S)C3=CC=NC=C3

InChI

InChI=1S/C15H14N4S/c20-15-18-17-14(13-6-9-16-10-7-13)19(15)11-8-12-4-2-1-3-5-12/h1-7,9-10H,8,11H2,(H,18,20)