3,4-dimethyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3,4-dimethyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-dimethyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-dimethyl-5-[(4-phenylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-dimethyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-dimethyl-5-[(4-phenylbenzyl)thio]-1,2,4-triazole Formula: C17H17N3S MolecularWeight: 295.40198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1C)SCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3S/c1-13-18-19-17(20(13)2)21-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3