methyl 2-[2-[3-(3-methylphenoxy)propylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[3-(3-methylphenoxy)propylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[3-(3-methylphenoxy)propylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[3-(3-methylphenoxy)propylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-(3-methylphenoxy)propylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[3-(3-methylphenoxy)propylthio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C17H20N2O4S/c1-12-5-3-6-14(9-12)23-7-4-8-24-17-18-13(10-15(20)19-17)11-16(21)22-2/h3,5-6,9-10H,4,7-8,11H2,1-2H3,(H,18,19,20)