N-(3-acetamidophenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-(6-morpholinopyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[[6-(4-morpholinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(6-morpholinopyrimidin-4-yl)thio]acetamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC=NC(=C2)N3CCOCC3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC=NC(=C2)N3CCOCC3

InChI

InChI=1S/C18H21N5O3S/c1-13(24)21-14-3-2-4-15(9-14)22-17(25)11-27-18-10-16(19-12-20-18)23-5-7-26-8-6-23/h2-4,9-10,12H,5-8,11H2,1H3,(H,21,24)(H,22,25)