1-(2,4-dimethylphenyl)-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,4-dimethylphenyl)-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(2,4-dimethylphenyl)-2-[6-(1-piperidyl)pyrimidin-4-yl]sulfanyl-ethanone CAS Name: 1-(2,4-dimethylphenyl)-2-[[6-(1-piperidinyl)-4-pyrimidinyl]thio]ethanone IUPAC Name: 1-(2,4-dimethylphenyl)-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(2,4-dimethylphenyl)-2-[(6-piperidinopyrimidin-4-yl)thio]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CSC2=NC=NC(=C2)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CSC2=NC=NC(=C2)N3CCCCC3)C

InChI

InChI=1S/C19H23N3OS/c1-14-6-7-16(15(2)10-14)17(23)12-24-19-11-18(20-13-21-19)22-8-4-3-5-9-22/h6-7,10-11,13H,3-5,8-9,12H2,1-2H3