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

Systemtic Name: N-[2-cyclopentylsulfanyl-4-oxidanylidene-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[2-cyclopentylsulfanyl-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide CAS Name: N-[2-(cyclopentylthio)-4-oxo-6-(1-oxopropylamino)-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[2-cyclopentylsulfanyl-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[2-(cyclopentylthio)-4-keto-6-propionamido-1H-pyrimidin-5-yl]benzamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=O)N=C(N1)SC2CCCC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=C(C(=O)N=C(N1)SC2CCCC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4O3S/c1-2-14(24)20-16-15(21-17(25)12-8-4-3-5-9-12)18(26)23-19(22-16)27-13-10-6-7-11-13/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,21,25)(H2,20,22,23,24,26)