3-[[(3-chlorophenyl)amino]methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[(3-chlorophenyl)amino]methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3-chloroanilino)methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-chloroanilino)methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3-chloroanilino)methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3-chloroanilino)methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NNC2=S)CNC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NNC2=S)CNC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H17ClN4S/c18-14-7-4-8-15(11-14)19-12-16-20-21-17(23)22(16)10-9-13-5-2-1-3-6-13/h1-8,11,19H,9-10,12H2,(H,21,23)