3-[1-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)C

InChI

InChI=1S/C25H27N5O2S/c1-17-13-18(2)15-20(14-17)29-12-9-26-25(29)33-16-23(31)28-10-7-19(8-11-28)30-22-6-4-3-5-21(22)27-24(30)32/h3-6,9,12-15,19H,7-8,10-11,16H2,1-2H3,(H,27,32)