3-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[[2-(1-imidazolylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[2-(imidazol-1-ylmethyl)benzyl]propionamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCSC2=CC=C(C=C2)Cl)CN3C=CN=C3

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCSC2=CC=C(C=C2)Cl)CN3C=CN=C3

InChI

InChI=1S/C20H20ClN3OS/c21-18-5-7-19(8-6-18)26-12-9-20(25)23-13-16-3-1-2-4-17(16)14-24-11-10-22-15-24/h1-8,10-11,15H,9,12-14H2,(H,23,25)