4-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-isobutyl-benzamide CAS Name: 4-[[[4-(dimethylamino)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[[4-(dimethylamino)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-isobutyl-benzamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)C)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4OS/c1-17(2)15-25-23(29)20-12-10-18(11-13-20)16-30-24-26-21(14-22(27-24)28(3)4)19-8-6-5-7-9-19/h5-14,17H,15-16H2,1-4H3,(H,25,29)