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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=CN=C(C=C1)NC(=O)C(C)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=C(C=C1)NCC(C)C)[NH3+]

InChI

InChI=1S/C12H20N4O/c1-8(2)6-14-10-4-5-11(15-7-10)16-12(17)9(3)13/h4-5,7-9,14H,6,13H2,1-3H3,(H,15,16,17)/p+1/t9-/m0/s1