4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[2-methyl-4-(4-methylpiperazino)phenyl]benzamide Formula: C27H29N5OS MolecularWeight: 471.61706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H29N5OS/c1-19-17-22(32-15-13-31(2)14-16-32)11-12-23(19)28-26(33)21-9-7-20(8-10-21)18-34-27-29-24-5-3-4-6-25(24)30-27/h3-12,17H,13-16,18H2,1-2H3,(H,28,33)(H,29,30)