5-(1,3-benzothiazol-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(imidazol-1-ylmethyl)benzyl]thiophene-2-carboxamide Formula: C23H18N4OS2 MolecularWeight: 430.54522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)CN5C=CN=C5

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)CN5C=CN=C5

InChI

InChI=1S/C23H18N4OS2/c28-22(25-13-16-5-1-2-6-17(16)14-27-12-11-24-15-27)20-9-10-21(29-20)23-26-18-7-3-4-8-19(18)30-23/h1-12,15H,13-14H2,(H,25,28)