1,3-dicyclopropyl-3-(phenylmethylsulfanyl)butan-1-one

Systemtic Name: 1,3-dicyclopropyl-3-(phenylmethylsulfanyl)butan-1-one Openeye Name: 3-benzylsulfanyl-1,3-dicyclopropyl-butan-1-one CAS Name: 1,3-dicyclopropyl-3-(phenylmethylthio)-1-butanone IUPAC Name: 3-benzylsulfanyl-1,3-dicyclopropylbutan-1-one Traditional Name: 3-(benzylthio)-1,3-dicyclopropyl-butan-1-one Formula: C17H22OS MolecularWeight: 274.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1CC1)(C2CC2)SCC3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)C1CC1)(C2CC2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H22OS/c1-17(15-9-10-15,11-16(18)14-7-8-14)19-12-13-5-3-2-4-6-13/h2-6,14-15H,7-12H2,1H3