5-(1,2-dithiolan-3-yl)-N-[2-[3-oxidanyl-3-phenyl-2-pyridin-2-yl-1-(pyridin-2-ylamino)propyl]phenyl]pentanamide

Systemtic Name: 5-(1,2-dithiolan-3-yl)-N-[2-[3-oxidanyl-3-phenyl-2-pyridin-2-yl-1-(pyridin-2-ylamino)propyl]phenyl]pentanamide Openeye Name: 5-(dithiolan-3-yl)-N-[2-[3-hydroxy-3-phenyl-2-(2-pyridyl)-1-(2-pyridylamino)propyl]phenyl]pentanamide CAS Name: 5-(3-dithiolanyl)-N-[2-[3-hydroxy-3-phenyl-2-(2-pyridinyl)-1-(2-pyridinylamino)propyl]phenyl]pentanamide IUPAC Name: 5-(dithiolan-3-yl)-N-[2-[3-hydroxy-3-phenyl-2-pyridin-2-yl-1-(pyridin-2-ylamino)propyl]phenyl]pentanamide Traditional Name: 5-(dithiolan-3-yl)-N-[2-[3-hydroxy-3-phenyl-2-(2-pyridyl)-1-(2-pyridylamino)propyl]phenyl]valeramide Formula: C33H36N4O2S2 MolecularWeight: 584.79454

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Descriptors Computed from Structure

Canonical SMILES:

C1CSSC1CCCCC(=O)NC2=CC=CC=C2C(C(C3=CC=CC=N3)C(C4=CC=CC=C4)O)NC5=CC=CC=N5

Isomeric SMILES

C1CSSC1CCCCC(=O)NC2=CC=CC=C2C(C(C3=CC=CC=N3)C(C4=CC=CC=C4)O)NC5=CC=CC=N5

InChI

InChI=1S/C33H36N4O2S2/c38-30(19-7-4-14-25-20-23-40-41-25)36-27-16-6-5-15-26(27)32(37-29-18-9-11-22-35-29)31(28-17-8-10-21-34-28)33(39)24-12-2-1-3-13-24/h1-3,5-6,8-13,15-18,21-22,25,31-33,39H,4,7,14,19-20,23H2,(H,35,37)(H,36,38)