3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one

Systemtic Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one Openeye Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one CAS Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-(phenethylthio)-6-phenyl-4-pyrimidinone IUPAC Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-phenethylsulfanyl-6-phenylpyrimidin-4-one Traditional Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]-2-(phenethylthio)-6-phenyl-pyrimidin-4-one Formula: C29H27N3O2S MolecularWeight: 481.60858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CN3C(=O)C=C(N=C3SCCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CN3C(=O)C=C(N=C3SCCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O2S/c33-27-20-25(23-12-5-2-6-13-23)30-29(35-19-17-22-10-3-1-4-11-22)32(27)21-28(34)31-18-9-15-24-14-7-8-16-26(24)31/h1-8,10-14,16,20H,9,15,17-19,21H2