N-(3-acetamidophenyl)-2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[(5-acetyl-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(5-acetyl-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=CC(=C3)NC(=O)C)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=CC(=C3)NC(=O)C)C(=O)C

InChI

InChI=1S/C20H22N4O3S/c1-11-18(12(2)25)20(24-19(21-11)14-7-8-14)28-10-17(27)23-16-6-4-5-15(9-16)22-13(3)26/h4-6,9,14H,7-8,10H2,1-3H3,(H,22,26)(H,23,27)