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

Systemtic Name: ethyl 2-[(6-acetamido-5-benzamido-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate Openeye Name: ethyl 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate CAS Name: 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(6-acetamido-5-benzamido-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methylpropanoate Traditional Name: 2-[(6-acetamido-5-benzamido-4-keto-1H-pyrimidin-2-yl)thio]-2-methyl-propionic acid ethyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)(C)SC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22N4O5S/c1-5-28-17(27)19(3,4)29-18-22-14(20-11(2)24)13(16(26)23-18)21-15(25)12-9-7-6-8-10-12/h6-10H,5H2,1-4H3,(H,21,25)(H2,20,22,23,24,26)