4-cyclohexyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide

Systemtic Name: 4-cyclohexyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide Openeye Name: 4-cyclohexyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide CAS Name: 4-cyclohexyl-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]benzamide IUPAC Name: 4-cyclohexyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide Traditional Name: 4-cyclohexyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]benzamide Formula: C25H27N3OS MolecularWeight: 417.56638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4CCCCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4CCCCC4)C

InChI

InChI=1S/C25H27N3OS/c1-17-16-18(2)27-25(26-17)30-23-14-12-22(13-15-23)28-24(29)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h8-16,19H,3-7H2,1-2H3,(H,28,29)