N-[5-benzamido-2-(2-hydroxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]furan-2-carboxamide

Systemtic Name: N-[5-benzamido-2-(2-hydroxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]furan-2-carboxamide Openeye Name: N-[5-benzamido-2-(2-hydroxyethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]furan-2-carboxamide CAS Name: N-[5-benzamido-2-(2-hydroxyethylthio)-4-oxo-1H-pyrimidin-6-yl]-2-furancarboxamide IUPAC Name: N-[5-benzamido-2-(2-hydroxyethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]furan-2-carboxamide Traditional Name: N-[5-benzamido-2-(2-hydroxyethylthio)-4-keto-1H-pyrimidin-6-yl]-2-furamide Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCCO)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCCO)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H16N4O5S/c23-8-10-28-18-21-14(20-16(25)12-7-4-9-27-12)13(17(26)22-18)19-15(24)11-5-2-1-3-6-11/h1-7,9,23H,8,10H2,(H,19,24)(H2,20,21,22,25,26)