1-(4-methylpiperazin-1-yl)-2-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-methylpiperazin-1-yl)-2-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]ethanone Openeye Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)thio]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)thio]-1-(4-methylpiperazino)ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CSC2=NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)CSC2=NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c1-24-9-11-25(12-10-24)19(26)14-28-21-22-17-8-7-16(13-18(17)23-21)20(27)15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,22,23)