3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxy-pyridin-4-one

Systemtic Name: 3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxy-pyridin-4-one Openeye Name: 3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxy-pyridin-4-one CAS Name: 3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxy-4-pyridinone IUPAC Name: 3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxypyridin-4-one Traditional Name: 3-(2-cyclopentylsulfinylphenyl)-5-(3-hexylphenyl)-1-propoxy-4-pyridone Formula: C31H39NO3S MolecularWeight: 505.71126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC(=C1)C2=CN(C=C(C2=O)C3=CC=CC=C3S(=O)C4CCCC4)OCCC

Isomeric SMILES

CCCCCCC1=CC=CC(=C1)C2=CN(C=C(C2=O)C3=CC=CC=C3S(=O)C4CCCC4)OCCC

InChI

InChI=1S/C31H39NO3S/c1-3-5-6-7-13-24-14-12-15-25(21-24)28-22-32(35-20-4-2)23-29(31(28)33)27-18-10-11-19-30(27)36(34)26-16-8-9-17-26/h10-12,14-15,18-19,21-23,26H,3-9,13,16-17,20H2,1-2H3