3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[2-(4-methylphenyl)sulfanylethyl]propanamide

Systemtic Name: 3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[2-(4-methylphenyl)sulfanylethyl]propanamide Openeye Name: 3-(6-methyl-2-morpholino-4-oxo-1H-pyrimidin-5-yl)-N-[2-(p-tolylsulfanyl)ethyl]propanamide CAS Name: 3-[6-methyl-2-(4-morpholinyl)-4-oxo-1H-pyrimidin-5-yl]-N-[2-[(4-methylphenyl)thio]ethyl]propanamide IUPAC Name: 3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)-N-[2-(4-methylphenyl)sulfanylethyl]propanamide Traditional Name: 3-(4-keto-6-methyl-2-morpholino-1H-pyrimidin-5-yl)-N-[2-(p-tolylthio)ethyl]propionamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CCC2=C(NC(=NC2=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CCC2=C(NC(=NC2=O)N3CCOCC3)C

InChI

InChI=1S/C21H28N4O3S/c1-15-3-5-17(6-4-15)29-14-9-22-19(26)8-7-18-16(2)23-21(24-20(18)27)25-10-12-28-13-11-25/h3-6H,7-14H2,1-2H3,(H,22,26)(H,23,24,27)