3-(naphthalen-1-ylmethyl)-6-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 3-(naphthalen-1-ylmethyl)-6-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3-(1-naphthylmethyl)-6-phenyl-pyrimidin-4-one CAS Name: 3-(1-naphthalenylmethyl)-6-phenyl-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 2-benzylsulfanyl-3-(naphthalen-1-ylmethyl)-6-phenylpyrimidin-4-one Traditional Name: 2-(benzylthio)-3-(1-naphthylmethyl)-6-phenyl-pyrimidin-4-one Formula: C28H22N2OS MolecularWeight: 434.55208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H22N2OS/c31-27-18-26(23-13-5-2-6-14-23)29-28(32-20-21-10-3-1-4-11-21)30(27)19-24-16-9-15-22-12-7-8-17-25(22)24/h1-18H,19-20H2