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

Systemtic Name: 4-nitro-1,3-bis(piperidin-1-ylmethyl)benzimidazole-2-thione Openeye Name: 4-nitro-1,3-bis(1-piperidylmethyl)benzimidazole-2-thione CAS Name: 4-nitro-1,3-bis(1-piperidinylmethyl)-2-benzimidazolethione IUPAC Name: 4-nitro-1,3-bis(piperidin-1-ylmethyl)benzimidazole-2-thione Traditional Name: 4-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(=CC=C3)[N+](=O)[O-])N(C2=S)CN4CCCCC4

Isomeric SMILES

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

InChI

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