1-(4-methylsulfonylpiperazin-1-yl)-2-(1-pentylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(1-pentylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(1-pentylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(4-methylsulfonyl-1-piperazinyl)-2-[(1-pentyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(1-pentylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 2-[(1-amylbenzimidazol-2-yl)thio]-1-(4-mesylpiperazino)ethanone Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCCCCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H28N4O3S2/c1-3-4-7-10-23-17-9-6-5-8-16(17)20-19(23)27-15-18(24)21-11-13-22(14-12-21)28(2,25)26/h5-6,8-9H,3-4,7,10-15H2,1-2H3