[(2S)-1-[[5-(butylamino)pyridin-2-yl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[5-(butylamino)pyridin-2-yl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[[5-(butylamino)-2-pyridyl]amino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[5-(butylamino)-2-pyridinyl]amino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[[5-(butylamino)pyridin-2-yl]amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[[5-(butylamino)-2-pyridyl]amino]-2-keto-1-methyl-ethyl]ammonium Formula: C12H21N4O+ MolecularWeight: 237.32134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CN=C(C=C1)NC(=O)C(C)[NH3+]

Isomeric SMILES

CCCCNC1=CN=C(C=C1)NC(=O)[C@H](C)[NH3+]

InChI

InChI=1S/C12H20N4O/c1-3-4-7-14-10-5-6-11(15-8-10)16-12(17)9(2)13/h5-6,8-9,14H,3-4,7,13H2,1-2H3,(H,15,16,17)/p+1/t9-/m0/s1