2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[6-methyl-4-oxo-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[4-keto-6-methyl-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]-N-(4-pyridylmethyl)acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H22N4O2S/c1-14-18(12-19(26)23-13-16-8-10-22-11-9-16)20(27)25-21(24-14)28-15(2)17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3,(H,23,26)(H,24,25,27)