3-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C

InChI

InChI=1S/C20H23N5O2S/c1-13-11-14(2)22-19(21-13)28-12-18(26)24-9-7-15(8-10-24)25-17-6-4-3-5-16(17)23-20(25)27/h3-6,11,15H,7-10,12H2,1-2H3,(H,23,27)