6-[1-(2-methylpropyl)cyclopropyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 6-[1-(2-methylpropyl)cyclopropyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-6-(1-isobutylcyclopropyl)-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 2-hydroxy-6-[1-(2-methylpropyl)cyclopropyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-[1-(2-methylpropyl)cyclopropyl]-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-6-(1-isobutylcyclopropyl)-3-(o-cumenylthio)pyran-4-one Formula: C21H26O3S MolecularWeight: 358.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC1)C2=CC(=O)C(=C(O2)O)SC3=CC=CC=C3C(C)C

Isomeric SMILES

CC(C)CC1(CC1)C2=CC(=O)C(=C(O2)O)SC3=CC=CC=C3C(C)C

InChI

InChI=1S/C21H26O3S/c1-13(2)12-21(9-10-21)18-11-16(22)19(20(23)24-18)25-17-8-6-5-7-15(17)14(3)4/h5-8,11,13-14,23H,9-10,12H2,1-4H3