methyl 2-[2-(naphthalen-1-ylmethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-(naphthalen-1-ylmethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-(1-naphthylmethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-(1-naphthalenylmethylthio)-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(naphthalen-1-ylmethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-(1-naphthylmethylthio)-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C18H16N2O3S/c1-23-17(22)10-14-9-16(21)20-18(19-14)24-11-13-7-4-6-12-5-2-3-8-15(12)13/h2-9H,10-11H2,1H3,(H,19,20,21)