N-(3-ethanoylphenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-acetylphenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-acetylphenyl)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propionamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SC(C)C(=O)NC2=CC=CC(=C2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)SC(C)C(=O)NC2=CC=CC(=C2)C(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S/c1-14(26)18-10-7-11-19(12-18)25-22(27)15(2)28-21-13-20(23-16(3)24-21)17-8-5-4-6-9-17/h4-13,15H,1-3H3,(H,25,27)