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

Systemtic Name: 3-(2-methylphenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(o-tolyl)-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-methylphenyl)-5-[(5-phenyl-3-isoxazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methylphenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(o-tolyl)-5-[(5-phenylisoxazol-3-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C19H17N5OS MolecularWeight: 363.43618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H17N5OS/c1-13-7-5-6-10-16(13)18-21-22-19(24(18)20)26-12-15-11-17(25-23-15)14-8-3-2-4-9-14/h2-11H,12,20H2,1H3