N-(1H-imidazol-5-ylmethyl)-N-[(3-phenylphenyl)methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(1H-imidazol-5-ylmethyl)-N-[(3-phenylphenyl)methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(1H-imidazol-5-ylmethyl)-N-[(3-phenylphenyl)methyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-(1H-imidazol-5-ylmethyl)-N-[(3-phenylphenyl)methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(1H-imidazol-5-ylmethyl)-N-[(3-phenylphenyl)methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(1H-imidazol-5-ylmethyl)-N-(3-phenylbenzyl)-1,3-benzothiazole-6-carboxamide Formula: C25H20N4OS MolecularWeight: 424.5175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC=C2)CN(CC3=CN=CN3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC=C2)CN(CC3=CN=CN3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C25H20N4OS/c30-25(21-9-10-23-24(12-21)31-17-28-23)29(15-22-13-26-16-27-22)14-18-5-4-8-20(11-18)19-6-2-1-3-7-19/h1-13,16-17H,14-15H2,(H,26,27)