methyl (2S)-2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-(5-methyl-2,4-dioxo-1-pyrimidinyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-(2,4-diketo-5-methyl-pyrimidin-1-yl)acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CC(=O)N[C@@H](CCSC)C(=O)OC

InChI

InChI=1S/C13H19N3O5S/c1-8-6-16(13(20)15-11(8)18)7-10(17)14-9(4-5-22-3)12(19)21-2/h6,9H,4-5,7H2,1-3H3,(H,14,17)(H,15,18,20)/t9-/m0/s1