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

Systemtic Name: 3-(3-chlorophenyl)-5-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3-chlorophenyl)-5-[(5-methylisoxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3-chlorophenyl)-5-[(5-methyl-3-isoxazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3-chlorophenyl)-5-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(3-chlorophenyl)-5-[(5-methylisoxazol-3-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C13H12ClN5OS MolecularWeight: 321.78528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NN=C(N2N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=NO1)CSC2=NN=C(N2N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C13H12ClN5OS/c1-8-5-11(18-20-8)7-21-13-17-16-12(19(13)15)9-3-2-4-10(14)6-9/h2-6H,7,15H2,1H3