N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]quinoline-8-sulfonamide

Systemtic Name: N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]quinoline-8-sulfonamide Openeye Name: N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]quinoline-8-sulfonamide CAS Name: N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]-8-quinolinesulfonamide IUPAC Name: N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]quinoline-8-sulfonamide Traditional Name: N-[[(1S,2R)-2-butylcyclopropyl]-(4-phenylphenyl)methyl]quinoline-8-sulfonamide Formula: C29H30N2O2S MolecularWeight: 470.6257

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC1C(C2=CC=C(C=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCCC[C@@H]1C[C@@H]1C(C2=CC=C(C=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C29H30N2O2S/c1-2-3-9-25-20-26(25)28(24-17-15-22(16-18-24)21-10-5-4-6-11-21)31-34(32,33)27-14-7-12-23-13-8-19-30-29(23)27/h4-8,10-19,25-26,28,31H,2-3,9,20H2,1H3/t25-,26+,28?/m1/s1