N-[4-[2-[[(2S)-2-oxidanyl-3-pyridin-3-yloxy-propyl]amino]ethyl]phenyl]quinoline-3-sulfonamide

Systemtic Name: N-[4-[2-[[(2S)-2-oxidanyl-3-pyridin-3-yloxy-propyl]amino]ethyl]phenyl]quinoline-3-sulfonamide Openeye Name: N-[4-[2-[[(2S)-2-hydroxy-3-(3-pyridyloxy)propyl]amino]ethyl]phenyl]quinoline-3-sulfonamide CAS Name: N-[4-[2-[[(2S)-2-hydroxy-3-(3-pyridinyloxy)propyl]amino]ethyl]phenyl]-3-quinolinesulfonamide IUPAC Name: N-[4-[2-[[(2S)-2-hydroxy-3-pyridin-3-yloxypropyl]amino]ethyl]phenyl]quinoline-3-sulfonamide Traditional Name: N-[4-[2-[[(2S)-2-hydroxy-3-(3-pyridyloxy)propyl]amino]ethyl]phenyl]quinoline-3-sulfonamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)S(=O)(=O)NC3=CC=C(C=C3)CCNCC(COC4=CN=CC=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)S(=O)(=O)NC3=CC=C(C=C3)CCNC[C@@H](COC4=CN=CC=C4)O

InChI

InChI=1S/C25H26N4O4S/c30-22(18-33-23-5-3-12-26-16-23)15-27-13-11-19-7-9-21(10-8-19)29-34(31,32)24-14-20-4-1-2-6-25(20)28-17-24/h1-10,12,14,16-17,22,27,29-30H,11,13,15,18H2/t22-/m0/s1