3-[1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[2-[(methylthio)methyl]-1-benzimidazolyl]-1-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H25N5O2S/c1-31-15-21-24-17-6-2-4-8-19(17)27(21)14-22(29)26-12-10-16(11-13-26)28-20-9-5-3-7-18(20)25-23(28)30/h2-9,16H,10-15H2,1H3,(H,25,30)