(2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol

Systemtic Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol Openeye Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol CAS Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-[4-methyl-2-(methylthio)-5-pyrimidinyl]-1,2,4a,10b-tetrahydrophenanthridin-2-ol IUPAC Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-(4-methyl-2-methylsulfanylpyrimidin-5-yl)-1,2,4a,10b-tetrahydrophenanthridin-2-ol Traditional Name: (2R,4aR,10bR)-9-ethoxy-8-methoxy-6-[4-methyl-2-(methylthio)pyrimidin-5-yl]-1,2,4a,10b-tetrahydrophenanthridin-2-ol Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C3CC(C=CC3N=C2C4=CN=C(N=C4C)SC)O)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)[C@H]3C[C@H](C=C[C@H]3N=C2C4=CN=C(N=C4C)SC)O)OC

InChI

InChI=1S/C22H25N3O3S/c1-5-28-20-9-14-15-8-13(26)6-7-18(15)25-21(16(14)10-19(20)27-3)17-11-23-22(29-4)24-12(17)2/h6-7,9-11,13,15,18,26H,5,8H2,1-4H3/t13-,15+,18+/m0/s1