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

Systemtic Name: methyl 2-[2-[2-(3-methylphenoxy)ethylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(3-methylphenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[2-(3-methylphenoxy)ethylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(3-methylphenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[2-(3-methylphenoxy)ethylthio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C16H18N2O4S/c1-11-4-3-5-13(8-11)22-6-7-23-16-17-12(9-14(19)18-16)10-15(20)21-2/h3-5,8-9H,6-7,10H2,1-2H3,(H,17,18,19)