6-methyl-2-[3-(2-propanoylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[3-(2-propanoylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[3-(2-propanoylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[3-[2-(1-oxopropyl)phenoxy]propylthio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[3-(2-propanoylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-[3-(2-propionylphenoxy)propylthio]-1H-pyrimidin-4-one Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OCCCSC2=NC(=O)C=C(N2)C

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OCCCSC2=NC(=O)C=C(N2)C

InChI

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