6-naphthalen-1-ylsulfanyl-1-(phenethyloxymethyl)-5-propan-2-yl-pyrimidine-2,4-dione

Systemtic Name: 6-naphthalen-1-ylsulfanyl-1-(phenethyloxymethyl)-5-propan-2-yl-pyrimidine-2,4-dione Openeye Name: 5-isopropyl-6-(1-naphthylsulfanyl)-1-(phenethyloxymethyl)pyrimidine-2,4-dione CAS Name: 6-(1-naphthalenylthio)-1-(phenethyloxymethyl)-5-propan-2-ylpyrimidine-2,4-dione IUPAC Name: 6-naphthalen-1-ylsulfanyl-1-(phenethyloxymethyl)-5-propan-2-ylpyrimidine-2,4-dione Traditional Name: 5-isopropyl-6-(1-naphthylthio)-1-(phenethyloxymethyl)pyrimidine-2,4-quinone Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=O)NC1=O)COCCC2=CC=CC=C2)SC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=C(N(C(=O)NC1=O)COCCC2=CC=CC=C2)SC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H26N2O3S/c1-18(2)23-24(29)27-26(30)28(17-31-16-15-19-9-4-3-5-10-19)25(23)32-22-14-8-12-20-11-6-7-13-21(20)22/h3-14,18H,15-17H2,1-2H3,(H,27,29,30)