6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylsulfanyl)cyclohexan-1-one

Systemtic Name: 6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylsulfanyl)cyclohexan-1-one Openeye Name: 6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylsulfanyl)cyclohexanone CAS Name: 6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylthio)-1-cyclohexanone IUPAC Name: 6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylsulfanyl)cyclohexan-1-one Traditional Name: 6-[2-(1,3-dioxan-2-yl)ethyl]-2,2-bis(phenylthio)cyclohexanone Formula: C24H28O3S2 MolecularWeight: 428.60732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C(C1)(SC2=CC=CC=C2)SC3=CC=CC=C3)CCC4OCCCO4

Isomeric SMILES

C1CC(C(=O)C(C1)(SC2=CC=CC=C2)SC3=CC=CC=C3)CCC4OCCCO4

InChI

InChI=1S/C24H28O3S2/c25-23-19(14-15-22-26-17-8-18-27-22)9-7-16-24(23,28-20-10-3-1-4-11-20)29-21-12-5-2-6-13-21/h1-6,10-13,19,22H,7-9,14-18H2