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

Systemtic Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-piperidin-1-ylsulfonylphenyl)ethanone Openeye Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-[4-(1-piperidylsulfonyl)phenyl]ethanone CAS Name: 2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-[4-(1-piperidinylsulfonyl)phenyl]ethanone IUPAC Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-piperidin-1-ylsulfonylphenyl)ethanone Traditional Name: 1-(4-piperidinosulfonylphenyl)-2-[(1-p-phenetylbenzimidazol-2-yl)thio]ethanone Formula: C28H29N3O4S2 MolecularWeight: 535.67756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C28H29N3O4S2/c1-2-35-23-14-12-22(13-15-23)31-26-9-5-4-8-25(26)29-28(31)36-20-27(32)21-10-16-24(17-11-21)37(33,34)30-18-6-3-7-19-30/h4-5,8-17H,2-3,6-7,18-20H2,1H3