2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: N-[4-(4-mesylpiperazino)phenyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide Formula: C21H25N5O3S2 MolecularWeight: 459.5849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H25N5O3S2/c1-15-3-8-18-19(13-15)24-21(23-18)30-14-20(27)22-16-4-6-17(7-5-16)25-9-11-26(12-10-25)31(2,28)29/h3-8,13H,9-12,14H2,1-2H3,(H,22,27)(H,23,24)