6-(1-phenethylcyclopropyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-2-one

Systemtic Name: 6-(1-phenethylcyclopropyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-2-one Openeye Name: 3-(2-isopropylphenyl)sulfanyl-6-(1-phenethylcyclopropyl)pyran-2-one CAS Name: 6-(1-phenethylcyclopropyl)-3-[(2-propan-2-ylphenyl)thio]-2-pyranone IUPAC Name: 6-(1-phenethylcyclopropyl)-3-(2-propan-2-ylphenyl)sulfanylpyran-2-one Traditional Name: 3-(o-cumenylthio)-6-(1-phenethylcyclopropyl)pyran-2-one Formula: C25H26O2S MolecularWeight: 390.53774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C25H26O2S/c1-18(2)20-10-6-7-11-21(20)28-22-12-13-23(27-24(22)26)25(16-17-25)15-14-19-8-4-3-5-9-19/h3-13,18H,14-17H2,1-2H3