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

Systemtic Name: N-[4-oxidanylidene-6-(propanoylamino)-2-propylsulfanyl-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[4-oxo-6-(propanoylamino)-2-propylsulfanyl-1H-pyrimidin-5-yl]benzamide CAS Name: N-[4-oxo-6-(1-oxopropylamino)-2-(propylthio)-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[4-oxo-6-(propanoylamino)-2-propylsulfanyl-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[4-keto-6-propionamido-2-(propylthio)-1H-pyrimidin-5-yl]benzamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=O)C(=C(N1)NC(=O)CC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCSC1=NC(=O)C(=C(N1)NC(=O)CC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H20N4O3S/c1-3-10-25-17-20-14(18-12(22)4-2)13(16(24)21-17)19-15(23)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,19,23)(H2,18,20,21,22,24)