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

Systemtic Name: 4-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Openeye Name: 4-[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide CAS Name: 4-[[[4-(dimethylamino)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-(2-methoxyethyl)benzamide IUPAC Name: 4-[[4-(dimethylamino)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Traditional Name: 4-[[[4-(dimethylamino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-(2-methoxyethyl)benzamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2S/c1-27(2)21-15-20(18-7-5-4-6-8-18)25-23(26-21)30-16-17-9-11-19(12-10-17)22(28)24-13-14-29-3/h4-12,15H,13-14,16H2,1-3H3,(H,24,28)