2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-piperidin-1-ylphenyl)benzamide

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-piperidin-1-ylphenyl)benzamide Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[4-(1-piperidyl)phenyl]benzamide CAS Name: 2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N-[4-(1-piperidinyl)phenyl]benzamide IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-piperidin-1-ylphenyl)benzamide Traditional Name: 2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N-(4-piperidinophenyl)benzamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)N4CCCCC4)C

InChI

InChI=1S/C25H28N4OS/c1-18-16-19(2)27-25(26-18)31-17-20-8-4-5-9-23(20)24(30)28-21-10-12-22(13-11-21)29-14-6-3-7-15-29/h4-5,8-13,16H,3,6-7,14-15,17H2,1-2H3,(H,28,30)