2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-(4-tosylpiperazino)ethanone Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C21H24N4O3S2/c1-15-3-6-17(7-4-15)30(27,28)25-11-9-24(10-12-25)20(26)14-29-21-22-18-8-5-16(2)13-19(18)23-21/h3-8,13H,9-12,14H2,1-2H3,(H,22,23)