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

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[2-(1-imidazolylmethyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 2-[(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:

CC(C(=O)NCC1=CC=CC=C1CN2C=CN=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1CN2C=CN=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-15(26-19-8-6-18(21)7-9-19)20(25)23-12-16-4-2-3-5-17(16)13-24-11-10-22-14-24/h2-11,14-15H,12-13H2,1H3,(H,23,25)