methyl 2-[2-[(1R)-1-cyanoethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(1R)-1-cyanoethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1R)-1-cyanoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(1R)-1-cyanoethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(1R)-1-cyanoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(1R)-1-cyanoethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C10H11N3O3S MolecularWeight: 253.27764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC(=O)C=C(N1)CC(=O)OC

Isomeric SMILES

C[C@H](C#N)SC1=NC(=O)C=C(N1)CC(=O)OC

InChI

InChI=1S/C10H11N3O3S/c1-6(5-11)17-10-12-7(3-8(14)13-10)4-9(15)16-2/h3,6H,4H2,1-2H3,(H,12,13,14)/t6-/m1/s1