(17-ethylsulfanyl-9-fluoranyl-10,13-dimethyl-3-oxidanylidene-17-prop-2-enylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl) ethanoate

Systemtic Name: (17-ethylsulfanyl-9-fluoranyl-10,13-dimethyl-3-oxidanylidene-17-prop-2-enylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl) ethanoate Openeye Name: (17-allylsulfanyl-17-ethylsulfanyl-9-fluoro-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl) acetate CAS Name: acetic acid [17-(ethylthio)-9-fluoro-10,13-dimethyl-3-oxo-17-(prop-2-enylthio)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl] ester IUPAC Name: (17-ethylsulfanyl-9-fluoro-10,13-dimethyl-3-oxo-17-prop-2-enylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl) acetate Traditional Name: acetic acid [17-(allylthio)-17-(ethylthio)-9-fluoro-3-keto-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl] ester Formula: C26H35FO3S2 MolecularWeight: 478.682703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CCC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)OC(=O)C)C)SCC=C

Isomeric SMILES

CCSC1(CCC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)OC(=O)C)C)SCC=C

InChI

InChI=1S/C26H35FO3S2/c1-6-14-32-25(31-7-2)13-11-20-21-9-8-18-15-19(29)10-12-23(18,4)26(21,27)22(30-17(3)28)16-24(20,25)5/h6,10,12,15,20-22H,1,7-9,11,13-14,16H2,2-5H3