2-[2-(naphthalen-2-ylmethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-(naphthalen-2-ylmethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-(2-naphthylmethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]-N-phenethyl-acetamide CAS Name: 2-[2-(2-naphthalenylmethylthio)-4-oxo-1H-pyrimidin-6-yl]-N-phenethylacetamide IUPAC Name: 2-[2-(naphthalen-2-ylmethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]-N-phenethylacetamide Traditional Name: 2-[4-keto-2-(2-naphthylmethylthio)-1H-pyrimidin-6-yl]-N-phenethyl-acetamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CC2=CC(=O)N=C(N2)SCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CC2=CC(=O)N=C(N2)SCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H23N3O2S/c29-23(26-13-12-18-6-2-1-3-7-18)15-22-16-24(30)28-25(27-22)31-17-19-10-11-20-8-4-5-9-21(20)14-19/h1-11,14,16H,12-13,15,17H2,(H,26,29)(H,27,28,30)