N-(2,6-dimethylphenyl)-2-[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2,6-dimethylphenyl)acetamide Formula: C27H28N4OS MolecularWeight: 456.60242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(N2C3=CC(=C(C=C3)C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(N2C3=CC(=C(C=C3)C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS/c1-18-13-14-23(15-21(18)4)31-24(16-22-11-6-5-7-12-22)29-30-27(31)33-17-25(32)28-26-19(2)9-8-10-20(26)3/h5-15H,16-17H2,1-4H3,(H,28,32)