5-phenylsulfanyl-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one

Systemtic Name: 5-phenylsulfanyl-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one Openeye Name: 5-phenylsulfanyl-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one CAS Name: 5-(phenylthio)-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one IUPAC Name: 5-phenylsulfanyl-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one Traditional Name: 5-(phenylthio)-2,3,3a,5,6,8a-hexahydro-1H-azulen-4-one Formula: C16H18OS MolecularWeight: 258.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CCC(C(=O)C2C1)SC3=CC=CC=C3

Isomeric SMILES

C1CC2C=CCC(C(=O)C2C1)SC3=CC=CC=C3

InChI

InChI=1S/C16H18OS/c17-16-14-10-4-6-12(14)7-5-11-15(16)18-13-8-2-1-3-9-13/h1-3,5,7-9,12,14-15H,4,6,10-11H2