N-tert-butyl-3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-tert-butyl-3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-tert-butyl-3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-tert-butyl-3-[(4,6-diphenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: N-tert-butyl-3-(4,6-diphenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-tert-butyl-3-[(4,6-diphenylpyrimidin-2-yl)thio]propionamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CCSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CCSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3OS/c1-23(2,3)26-21(27)14-15-28-22-24-19(17-10-6-4-7-11-17)16-20(25-22)18-12-8-5-9-13-18/h4-13,16H,14-15H2,1-3H3,(H,26,27)