2-[[2,3-bis(chloranyl)phenyl]methylsulfanyl]-6-fluoranyl-5-piperazin-1-yl-1H-benzimidazole

Systemtic Name: 2-[[2,3-bis(chloranyl)phenyl]methylsulfanyl]-6-fluoranyl-5-piperazin-1-yl-1H-benzimidazole Openeye Name: 2-[(2,3-dichlorophenyl)methylsulfanyl]-6-fluoro-5-piperazin-1-yl-1H-benzimidazole CAS Name: 2-[(2,3-dichlorophenyl)methylthio]-6-fluoro-5-(1-piperazinyl)-1H-benzimidazole IUPAC Name: 2-[(2,3-dichlorophenyl)methylsulfanyl]-6-fluoro-5-piperazin-1-yl-1H-benzimidazole Traditional Name: 2-[(2,3-dichlorobenzyl)thio]-6-fluoro-5-piperazino-1H-benzimidazole Formula: C18H17Cl2FN4S MolecularWeight: 411.323783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N=C(N3)SCC4=C(C(=CC=C4)Cl)Cl)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N=C(N3)SCC4=C(C(=CC=C4)Cl)Cl)F

InChI

InChI=1S/C18H17Cl2FN4S/c19-12-3-1-2-11(17(12)20)10-26-18-23-14-8-13(21)16(9-15(14)24-18)25-6-4-22-5-7-25/h1-3,8-9,22H,4-7,10H2,(H,23,24)