N-[1-(4-imidazol-1-ylphenyl)ethyl]-2-[(3-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-2-[(3-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-2-(m-tolylmethylsulfanyl)acetamide CAS Name: N-[1-[4-(1-imidazolyl)phenyl]ethyl]-2-[(3-methylphenyl)methylthio]acetamide IUPAC Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-2-[(3-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-2-[(3-methylbenzyl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3

InChI

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