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

Systemtic Name: methyl 2-[2-[(2R)-2-cyanopropyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(2R)-2-cyanopropyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(2R)-2-cyanopropyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2R)-2-cyanopropyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(2R)-2-cyanopropyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC(=O)C=C(N1)CC(=O)OC)C#N

Isomeric SMILES

C[C@@H](CSC1=NC(=O)C=C(N1)CC(=O)OC)C#N

InChI

InChI=1S/C11H13N3O3S/c1-7(5-12)6-18-11-13-8(3-9(15)14-11)4-10(16)17-2/h3,7H,4,6H2,1-2H3,(H,13,14,15)/t7-/m1/s1