13-methyl-2-[3-(methylamino)phenyl]-5,17-bis(oxidanyl)-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione

Systemtic Name: 13-methyl-2-[3-(methylamino)phenyl]-5,17-bis(oxidanyl)-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione Openeye Name: 5,17-dihydroxy-13-methyl-2-[3-(methylamino)phenyl]-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione CAS Name: 5,17-dihydroxy-13-methyl-2-[3-(methylamino)phenyl]-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione IUPAC Name: 5,17-dihydroxy-13-methyl-2-[3-(methylamino)phenyl]-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione Traditional Name: 5,17-dihydroxy-13-methyl-2-[3-(methylamino)phenyl]-1,2,4,6,7,8,10,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3-thione Formula: C25H33NO2S MolecularWeight: 411.60002

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC=C3C(C1CCC2O)CCC4(C3CC(C(=S)C4)C5=CC(=CC=C5)NC)O

Isomeric SMILES

CC12CC=C3C(C1CCC2O)CCC4(C3CC(C(=S)C4)C5=CC(=CC=C5)NC)O

InChI

InChI=1S/C25H33NO2S/c1-24-10-8-18-17(20(24)6-7-23(24)27)9-11-25(28)14-22(29)19(13-21(18)25)15-4-3-5-16(12-15)26-2/h3-5,8,12,17,19-21,23,26-28H,6-7,9-11,13-14H2,1-2H3