2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2-phenylpropyl)ethanamide

Systemtic Name: 2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2-phenylpropyl)ethanamide Openeye Name: 2-(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2-phenylpropyl)acetamide CAS Name: 2-[(5-acetyl-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-(2-phenylpropyl)acetamide IUPAC Name: 2-(5-acetyl-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-(2-phenylpropyl)acetamide Traditional Name: 2-[(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-(2-phenylpropyl)acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NCC(C)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NCC(C)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H25N3O2S/c1-13(16-7-5-4-6-8-16)11-22-18(26)12-27-21-19(15(3)25)14(2)23-20(24-21)17-9-10-17/h4-8,13,17H,9-12H2,1-3H3,(H,22,26)