N-(3-cyclohexyloxypropyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(3-cyclohexyloxypropyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[3-(cyclohexoxy)propyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(3-cyclohexyloxypropyl)-2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(3-cyclohexyloxypropyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[3-(cyclohexoxy)propyl]-2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NCCCOC3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NCCCOC3CCCCC3)C

InChI

InChI=1S/C23H31N3O2S/c1-17-15-18(2)26-23(25-17)29-16-19-9-6-7-12-21(19)22(27)24-13-8-14-28-20-10-4-3-5-11-20/h6-7,9,12,15,20H,3-5,8,10-11,13-14,16H2,1-2H3,(H,24,27)