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Methyl 2-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4-methylpentanoate
SpectraBase Compound ID HAEpzBKgcRx
InChI InChI=1S/C14H21N3O5S/c1-8(2)5-9(13(20)22-4)15-11(19)7-23-14-16-10(18)6-12(17-14)21-3/h6,8-9H,5,7H2,1-4H3,(H,15,19)(H,16,17,18)
InChIKey MEJKIOYWAQHZIL-UHFFFAOYSA-N
Mol Weight 343.4 g/mol
Molecular Formula C14H21N3O5S
Exact Mass 343.120192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CyLIAiAKtUP
Name Methyl 2-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4-methylpentanoate
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Formula C14H21N3O5S
InChI InChI=1S/C14H21N3O5S/c1-8(2)5-9(13(20)22-4)15-11(19)7-23-14-16-10(18)6-12(17-14)21-3/h6,8-9H,5,7H2,1-4H3,(H,15,19)(H,16,17,18)
InChIKey MEJKIOYWAQHZIL-UHFFFAOYSA-N
Molecular Weight 343.398 g/mol
SMILES N1C(C=C(N=C1SCC(=O)NC(C(OC)=O)CC(C)C)OC)=O
SPLASH splash10-0077-9810000000-6d64a30400544e15e8fb
Source of Spectrum IY-2-5084-3
Synonyms Pentanoic acid, 2-[[2-[(1,6-dihydro-4-methoxy-6-oxo-2-pyrimidinyl)thio]acetyl]amino]-4-methyl-, methyl ester 2-[[2-[(4-methoxy-6-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester Methyl 2-[[2-[(4-methoxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]-4-methylpentanoate Methyl 2-[[2-[(4-methoxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]-4-methyl-pentanoate Methyl 2-[2-[(4-methoxy-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]-4-methyl-pentanoate
Wiley ID 1658826