6-chloranyl-2-(oxolan-3-ylmethylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-(oxolan-3-ylmethylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole Openeye Name: 6-chloro-5-piperazin-1-yl-2-(tetrahydrofuran-3-ylmethylsulfanyl)-1H-benzimidazole CAS Name: 6-chloro-2-(3-oxolanylmethylthio)-5-(1-piperazinyl)-1H-benzimidazole IUPAC Name: 6-chloro-2-(oxolan-3-ylmethylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole Traditional Name: 6-chloro-5-piperazino-2-(tetrahydrofuran-3-ylmethylthio)-1H-benzimidazole Formula: C16H21ClN4OS MolecularWeight: 352.88214

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1CSC2=NC3=CC(=C(C=C3N2)Cl)N4CCNCC4

Isomeric SMILES

C1COCC1CSC2=NC3=CC(=C(C=C3N2)Cl)N4CCNCC4

InChI

InChI=1S/C16H21ClN4OS/c17-12-7-13-14(8-15(12)21-4-2-18-3-5-21)20-16(19-13)23-10-11-1-6-22-9-11/h7-8,11,18H,1-6,9-10H2,(H,19,20)