2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanone CAS Name: 2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethanone IUPAC Name: 2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]ethanone Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-31-19-18-29-23-12-6-5-11-22(23)26-25(29)32-20-24(30)28-16-14-27(15-17-28)13-7-10-21-8-3-2-4-9-21/h2-12H,13-20H2,1H3/b10-7+