methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[2-oxo-2-(thiophene-2-carbonylamino)ethyl]sulfanyl-1H-pyrimidin-6-yl]acetate CAS Name: 2-[4-oxo-2-[[2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[2-oxo-2-(thiophene-2-carbonylamino)ethyl]sulfanyl-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-(2-thenoylamino)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C14H13N3O5S2 MolecularWeight: 367.40012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NC(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C14H13N3O5S2/c1-22-12(20)6-8-5-10(18)17-14(15-8)24-7-11(19)16-13(21)9-3-2-4-23-9/h2-5H,6-7H2,1H3,(H,15,17,18)(H,16,19,21)