2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]-N-pentyl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]-N-pentyl-ethanamide Openeye Name: 2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)-N-pentyl-acetamide CAS Name: 2-[4-oxo-2-(phenylmethylthio)-1H-pyrimidin-6-yl]-N-pentylacetamide IUPAC Name: 2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)-N-pentylacetamide Traditional Name: N-amyl-2-[2-(benzylthio)-4-keto-1H-pyrimidin-6-yl]acetamide Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

Isomeric SMILES

CCCCCNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O2S/c1-2-3-7-10-19-16(22)11-15-12-17(23)21-18(20-15)24-13-14-8-5-4-6-9-14/h4-6,8-9,12H,2-3,7,10-11,13H2,1H3,(H,19,22)(H,20,21,23)