1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]urea

Systemtic Name: 1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]urea Openeye Name: 1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]urea CAS Name: 1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)-2-pyridin-1-iumyl]amino]urea IUPAC Name: 1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]urea Traditional Name: 1-butyl-3-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]urea Formula: C15H26N7O+ MolecularWeight: 320.41324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NNC1=[NH+]C(=C(C(=C1)N(C)C)C#N)N(C)C

Isomeric SMILES

CCCCNC(=O)NNC1=[NH+]C(=C(C(=C1)N(C)C)C#N)N(C)C

InChI

InChI=1S/C15H25N7O/c1-6-7-8-17-15(23)20-19-13-9-12(21(2)3)11(10-16)14(18-13)22(4)5/h9H,6-8H2,1-5H3,(H,18,19)(H2,17,20,23)/p+1