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

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-pyrrolidin-1-ylphenyl)benzamide Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-pyrrolidin-1-ylphenyl)benzamide CAS Name: 2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N-[4-(1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(4-pyrrolidin-1-ylphenyl)benzamide Traditional Name: 2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N-(4-pyrrolidinophenyl)benzamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)N4CCCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)N4CCCC4)C

InChI

InChI=1S/C24H26N4OS/c1-17-15-18(2)26-24(25-17)30-16-19-7-3-4-8-22(19)23(29)27-20-9-11-21(12-10-20)28-13-5-6-14-28/h3-4,7-12,15H,5-6,13-14,16H2,1-2H3,(H,27,29)