3-(2-chlorophenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-chlorophenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-chlorophenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-chlorophenyl)-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-chlorophenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-chlorophenyl)-5-[(2-phenoxybenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2CSC3=NN=C(N3N)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2CSC3=NN=C(N3N)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H17ClN4OS/c22-18-12-6-5-11-17(18)20-24-25-21(26(20)23)28-14-15-8-4-7-13-19(15)27-16-9-2-1-3-10-16/h1-13H,14,23H2