N-[4-oxidanylidene-2-(2-oxidanylidenepropylsulfanyl)-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide

Systemtic Name: N-[4-oxidanylidene-2-(2-oxidanylidenepropylsulfanyl)-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[2-acetonylsulfanyl-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide CAS Name: N-[4-oxo-6-(1-oxopropylamino)-2-(2-oxopropylthio)-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[4-oxo-2-(2-oxopropylsulfanyl)-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[2-(acetonylthio)-4-keto-6-propionamido-1H-pyrimidin-5-yl]benzamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O4S/c1-3-12(23)18-14-13(19-15(24)11-7-5-4-6-8-11)16(25)21-17(20-14)26-9-10(2)22/h4-8H,3,9H2,1-2H3,(H,19,24)(H2,18,20,21,23,25)