4-[[6-ethyl-2-(4-methylsulfanylphenyl)-6H-phenanthridin-5-yl]sulfonyl]-2-methyl-phenol

Systemtic Name: 4-[[6-ethyl-2-(4-methylsulfanylphenyl)-6H-phenanthridin-5-yl]sulfonyl]-2-methyl-phenol Openeye Name: 4-[[6-ethyl-2-(4-methylsulfanylphenyl)-6H-phenanthridin-5-yl]sulfonyl]-2-methyl-phenol CAS Name: 4-[[6-ethyl-2-[4-(methylthio)phenyl]-6H-phenanthridin-5-yl]sulfonyl]-2-methylphenol IUPAC Name: 4-[[6-ethyl-2-(4-methylsulfanylphenyl)-6H-phenanthridin-5-yl]sulfonyl]-2-methylphenol Traditional Name: 4-[[6-ethyl-2-[4-(methylthio)phenyl]-6H-phenanthridin-5-yl]sulfonyl]-2-methyl-phenol Formula: C29H27NO3S2 MolecularWeight: 501.65958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=CC=CC=C2C3=C(N1S(=O)(=O)C4=CC(=C(C=C4)O)C)C=CC(=C3)C5=CC=C(C=C5)SC

Isomeric SMILES

CCC1C2=CC=CC=C2C3=C(N1S(=O)(=O)C4=CC(=C(C=C4)O)C)C=CC(=C3)C5=CC=C(C=C5)SC

InChI

InChI=1S/C29H27NO3S2/c1-4-27-25-8-6-5-7-24(25)26-18-21(20-9-12-22(34-3)13-10-20)11-15-28(26)30(27)35(32,33)23-14-16-29(31)19(2)17-23/h5-18,27,31H,4H2,1-3H3