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

Systemtic Name: methyl 2-[4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[4-oxo-2-[[(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl]sulfanyl-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(1R)-2-(allylamino)-2-keto-1-methyl-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NC(=O)C=C(N1)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4S/c1-4-5-14-12(19)8(2)21-13-15-9(6-10(17)16-13)7-11(18)20-3/h4,6,8H,1,5,7H2,2-3H3,(H,14,19)(H,15,16,17)/t8-/m1/s1