5-nitro-1,3-bis(piperidin-1-ylmethyl)benzimidazole-2-thione

Systemtic Name: 5-nitro-1,3-bis(piperidin-1-ylmethyl)benzimidazole-2-thione Openeye Name: 5-nitro-1,3-bis(1-piperidylmethyl)benzimidazole-2-thione CAS Name: 5-nitro-1,3-bis(1-piperidinylmethyl)-2-benzimidazolethione IUPAC Name: 5-nitro-1,3-bis(piperidin-1-ylmethyl)benzimidazole-2-thione Traditional Name: 5-nitro-1,3-bis(piperidinomethyl)benzimidazole-2-thione Formula: C19H27N5O2S MolecularWeight: 389.51498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])N(C2=S)CN4CCCCC4

Isomeric SMILES

C1CCN(CC1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])N(C2=S)CN4CCCCC4

InChI

InChI=1S/C19H27N5O2S/c25-24(26)16-7-8-17-18(13-16)23(15-21-11-5-2-6-12-21)19(27)22(17)14-20-9-3-1-4-10-20/h7-8,13H,1-6,9-12,14-15H2