4-(1,3-dithiolan-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-[2-(imidazol-1-ylmethyl)benzyl]benzamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

InChI

InChI=1S/C21H21N3OS2/c25-20(16-5-7-17(8-6-16)21-26-11-12-27-21)23-13-18-3-1-2-4-19(18)14-24-10-9-22-15-24/h1-10,15,21H,11-14H2,(H,23,25)