2-[3-(1H-imidazol-5-yl)propyl]-1-[2-[(3-oxidanylpyridin-2-yl)methylsulfanyl]ethyl]guanidine

Systemtic Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[2-[(3-oxidanylpyridin-2-yl)methylsulfanyl]ethyl]guanidine Openeye Name: 1-[2-[(3-hydroxy-2-pyridyl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 1-[2-[(3-hydroxy-2-pyridinyl)methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine IUPAC Name: 1-[2-[(3-hydroxypyridin-2-yl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 1-[2-[(3-hydroxy-2-pyridyl)methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C15H22N6OS MolecularWeight: 334.43978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CSCCNC(=NCCCC2=CN=CN2)N)O

Isomeric SMILES

C1=CC(=C(N=C1)CSCCNC(=NCCCC2=CN=CN2)N)O

InChI

InChI=1S/C15H22N6OS/c16-15(19-6-1-3-12-9-17-11-21-12)20-7-8-23-10-13-14(22)4-2-5-18-13/h2,4-5,9,11,22H,1,3,6-8,10H2,(H,17,21)(H3,16,19,20)