(2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(2-methylsulfanylpyridin-3-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol

Systemtic Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(2-methylsulfanylpyridin-3-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol Openeye Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(2-methylsulfanyl-3-pyridyl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol CAS Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-[2-(methylthio)-3-pyridinyl]-1,2,4a,10b-tetrahydrophenanthridin-2-ol IUPAC Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(2-methylsulfanylpyridin-3-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol Traditional Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-[2-(methylthio)-3-pyridyl]-1,2,4a,10b-tetrahydrophenanthridin-2-ol Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C3CC(C=CC3N=C2C4=C(N=CC=C4)SC)O)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)[C@H]3C[C@H](C=C[C@H]3N=C2C4=C(N=CC=C4)SC)O)OC

InChI

InChI=1S/C22H24N2O3S/c1-4-27-20-11-15-16-10-13(25)7-8-18(16)24-21(17(15)12-19(20)26-2)14-6-5-9-23-22(14)28-3/h5-9,11-13,16,18,25H,4,10H2,1-3H3/t13-,16+,18+/m0/s1