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

Systemtic Name: N-(4-acetamidophenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propionamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-14(22(28)26-19-11-9-18(10-12-19)25-16(3)27)29-21-13-20(23-15(2)24-21)17-7-5-4-6-8-17/h4-14H,1-3H3,(H,25,27)(H,26,28)