2-[2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)ethanoylamino]ethyl-bis(2-methylpropyl)azanium

Systemtic Name: 2-[2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)ethanoylamino]ethyl-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-[2-[[2-(4-methyl-2-oxo-pyrimido[1,2-b]indazol-6-yl)acetyl]amino]ethyl]ammonium CAS Name: 2-[[2-(4-methyl-2-oxo-6-pyrimido[1,2-b]indazolyl)-1-oxoethyl]amino]ethyl-bis(2-methylpropyl)ammonium IUPAC Name: 2-[[2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)acetyl]amino]ethyl-bis(2-methylpropyl)azanium Traditional Name: diisobutyl-[2-[[2-(2-keto-4-methyl-pyrimid[1,2-b]indazol-6-yl)acetyl]amino]ethyl]ammonium Formula: C23H34N5O2+ MolecularWeight: 412.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)NCC[NH+](CC(C)C)CC(C)C

Isomeric SMILES

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)NCC[NH+](CC(C)C)CC(C)C

InChI

InChI=1S/C23H33N5O2/c1-16(2)13-26(14-17(3)4)11-10-24-22(30)15-27-20-9-7-6-8-19(20)23-25-21(29)12-18(5)28(23)27/h6-9,12,16-17H,10-11,13-15H2,1-5H3,(H,24,30)/p+1