2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-phenyl-imidazol-1-amine

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-phenyl-imidazol-1-amine Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-phenyl-imidazol-1-amine CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-phenyl-1-imidazolamine IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-phenylimidazol-1-amine Traditional Name: [2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-phenyl-imidazol-1-yl]amine Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC(=CN3N)C4=CC=CC=C4)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC(=CN3N)C4=CC=CC=C4)Cl

InChI

InChI=1S/C18H16ClN3O2S/c19-15-6-13-9-23-11-24-17(13)14(7-15)10-25-18-21-16(8-22(18)20)12-4-2-1-3-5-12/h1-8H,9-11,20H2