2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-4-phenyl-pentanal

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-4-phenyl-pentanal Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-4-phenyl-pentanal CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-4-phenylpentanal IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-4-phenylpentanal Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-4-phenyl-valeraldehyde Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C=O)SC1=NC(=CC(=N1)OC)OC)C2=CC=CC=C2

Isomeric SMILES

CC(CC(C=O)SC1=NC(=CC(=N1)OC)OC)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O3S/c1-12(13-7-5-4-6-8-13)9-14(11-20)23-17-18-15(21-2)10-16(19-17)22-3/h4-8,10-12,14H,9H2,1-3H3