N-[(9R,10R)-10-(6-chloranylpurin-9-yl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide

Systemtic Name: N-[(9R,10R)-10-(6-chloranylpurin-9-yl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide Openeye Name: N-[(9R,10R)-10-(6-chloropurin-9-yl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide CAS Name: N-[(9R,10R)-10-(6-chloro-9-purinyl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide IUPAC Name: N-[(9R,10R)-10-(6-chloropurin-9-yl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide Traditional Name: N-[(9R,10R)-10-(6-chloropurin-9-yl)-9,10-dihydrophenanthren-9-yl]methanesulfonamide Formula: C20H16ClN5O2S MolecularWeight: 425.89134

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1C(C2=CC=CC=C2C3=CC=CC=C13)N4C=NC5=C4N=CN=C5Cl

Isomeric SMILES

CS(=O)(=O)N[C@H]1[C@@H](C2=CC=CC=C2C3=CC=CC=C13)N4C=NC5=C4N=CN=C5Cl

InChI

InChI=1S/C20H16ClN5O2S/c1-29(27,28)25-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)18(16)26-11-24-17-19(21)22-10-23-20(17)26/h2-11,16,18,25H,1H3/t16-,18-/m1/s1