3-(4-chlorophenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-chlorophenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-chlorophenyl)-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-chlorophenyl)-5-[(5-phenyl-3-isoxazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-chlorophenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(4-chlorophenyl)-5-[(5-phenylisoxazol-3-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C18H14ClN5OS MolecularWeight: 383.85466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NN=C(N3N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NN=C(N3N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H14ClN5OS/c19-14-8-6-13(7-9-14)17-21-22-18(24(17)20)26-11-15-10-16(25-23-15)12-4-2-1-3-5-12/h1-10H,11,20H2