2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[1-(3,4-dimethylphenyl)-2-imidazolyl]thio]-N-phenethylacetamide IUPAC Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[1-(3,4-dimethylphenyl)imidazol-2-yl]thio]-N-phenethyl-acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3OS/c1-16-8-9-19(14-17(16)2)24-13-12-23-21(24)26-15-20(25)22-11-10-18-6-4-3-5-7-18/h3-9,12-14H,10-11,15H2,1-2H3,(H,22,25)