2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-cyclopropyl-5-phenyl-imidazole

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-cyclopropyl-5-phenyl-imidazole Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-cyclopropyl-5-phenyl-imidazole CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1-cyclopropyl-5-phenylimidazole IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-cyclopropyl-5-phenylimidazole Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1-cyclopropyl-5-phenyl-imidazole Formula: C21H19ClN2O2S MolecularWeight: 398.90576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=CN=C2SCC3=C4C(=CC(=C3)Cl)COCO4)C5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=CN=C2SCC3=C4C(=CC(=C3)Cl)COCO4)C5=CC=CC=C5

InChI

InChI=1S/C21H19ClN2O2S/c22-17-8-15-11-25-13-26-20(15)16(9-17)12-27-21-23-10-19(24(21)18-6-7-18)14-4-2-1-3-5-14/h1-5,8-10,18H,6-7,11-13H2