3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate

Systemtic Name: 3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate Openeye Name: 3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate CAS Name: 3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate IUPAC Name: 3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate Traditional Name: 3-(2-chlorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione hydrate Formula: C14H12ClN3OS MolecularWeight: 305.78258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CC=C3Cl.O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CC=C3Cl.O

InChI

InChI=1S/C14H10ClN3S.H2O/c15-12-9-5-4-8-11(12)13-16-17-14(19)18(13)10-6-2-1-3-7-10;/h1-9H,(H,17,19);1H2