N-(3-ethanoylphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(3-ethanoylphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-acetylphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-acetylphenyl)-3-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3-acetylphenyl)-3-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-3-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O2S/c1-15(25)17-8-5-9-18(12-17)24-20(26)10-11-27-21-13-19(22-14-23-21)16-6-3-2-4-7-16/h2-9,12-14H,10-11H2,1H3,(H,24,26)