N-(4-ethoxyphenyl)-2-[6-methyl-5-[(1S)-1-oxidanylethyl]-2-phenyl-pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[6-methyl-5-[(1S)-1-oxidanylethyl]-2-phenyl-pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenylpyrimidin-4-yl]sulfanylacetamide Traditional Name: 2-[[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-pyrimidin-4-yl]thio]-N-p-phenetyl-acetamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=C2C(C)O)C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=C2[C@H](C)O)C)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3S/c1-4-29-19-12-10-18(11-13-19)25-20(28)14-30-23-21(16(3)27)15(2)24-22(26-23)17-8-6-5-7-9-17/h5-13,16,27H,4,14H2,1-3H3,(H,25,28)/t16-/m0/s1