3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-morpholin-4-yl-2-phenyl-ethyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-morpholin-4-yl-2-phenyl-ethyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-morpholino-2-phenyl-ethyl)propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[2-(4-morpholinyl)-2-phenylethyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(2-morpholin-4-yl-2-phenylethyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(2-morpholino-2-phenyl-ethyl)propionamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC(C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC(C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C22H30N4O2S/c1-16-19(17(2)25-22(24-16)29-3)9-10-21(27)23-15-20(18-7-5-4-6-8-18)26-11-13-28-14-12-26/h4-8,20H,9-15H2,1-3H3,(H,23,27)