methyl 2-[(6-acetamido-5-benzamido-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(6-acetamido-5-benzamido-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-acetamido-5-benzamido-4-keto-1H-pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16N4O5S/c1-9(21)17-13-12(18-14(23)10-6-4-3-5-7-10)15(24)20-16(19-13)26-8-11(22)25-2/h3-7H,8H2,1-2H3,(H,18,23)(H2,17,19,20,21,24)