4-phenethyl-3-[4-(phenylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-phenethyl-3-[4-(phenylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[4-(benzenesulfonyl)phenyl]-4-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[4-(benzenesulfonyl)phenyl]-4-phenethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[4-(benzenesulfonyl)phenyl]-4-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-besylphenyl)-4-phenethyl-1H-1,2,4-triazole-5-thione Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NNC2=S)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NNC2=S)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O2S2/c26-29(27,19-9-5-2-6-10-19)20-13-11-18(12-14-20)21-23-24-22(28)25(21)16-15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,24,28)