3-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 3-[[[4-(dimethylamino)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[[4-(dimethylamino)-6-phenylpyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-benzyl-3-[[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]thio]methyl]benzamide Formula: C27H26N4OS MolecularWeight: 454.58654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H26N4OS/c1-31(2)25-17-24(22-13-7-4-8-14-22)29-27(30-25)33-19-21-12-9-15-23(16-21)26(32)28-18-20-10-5-3-6-11-20/h3-17H,18-19H2,1-2H3,(H,28,32)