2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 1-(4-mesylpiperazino)-2-[(1-p-phenetylbenzimidazol-2-yl)thio]ethanone Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C22H26N4O4S2/c1-3-30-18-10-8-17(9-11-18)26-20-7-5-4-6-19(20)23-22(26)31-16-21(27)24-12-14-25(15-13-24)32(2,28)29/h4-11H,3,12-16H2,1-2H3