methyl (2R)-4-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C16H23N3O3S2 MolecularWeight: 369.50212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCSC(C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCS[C@H](C2)C(=O)OC

InChI

InChI=1S/C16H23N3O3S2/c1-10-12(11(2)18-16(17-10)23-4)5-6-14(20)19-7-8-24-13(9-19)15(21)22-3/h13H,5-9H2,1-4H3/t13-/m1/s1