3,5-bis(azanyl)-6-chloranyl-N-[2-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]propyl]pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-6-chloranyl-N-[2-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]propyl]pyrazine-2-carboxamide Openeye Name: 3,5-diamino-6-chloro-N-[2-[[2-hydroxy-3-(1-naphthyloxy)propyl]amino]propyl]pyrazine-2-carboxamide CAS Name: 3,5-diamino-6-chloro-N-[2-[[2-hydroxy-3-(1-naphthalenyloxy)propyl]amino]propyl]-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-6-chloro-N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]propyl]pyrazine-2-carboxamide Traditional Name: 3,5-diamino-6-chloro-N-[2-[[2-hydroxy-3-(1-naphthoxy)propyl]amino]propyl]pyrazinamide Formula: C21H25ClN6O3 MolecularWeight: 444.9146

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(N=C(C(=N1)Cl)N)N)NCC(COC2=CC=CC3=CC=CC=C32)O

Isomeric SMILES

CC(CNC(=O)C1=C(N=C(C(=N1)Cl)N)N)NCC(COC2=CC=CC3=CC=CC=C32)O

InChI

InChI=1S/C21H25ClN6O3/c1-12(9-26-21(30)17-19(23)28-20(24)18(22)27-17)25-10-14(29)11-31-16-8-4-6-13-5-2-3-7-15(13)16/h2-8,12,14,25,29H,9-11H2,1H3,(H,26,30)(H4,23,24,28)