4-methyl-6-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]pyrimido[1,2-b]indazol-2-one

Systemtic Name: 4-methyl-6-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]pyrimido[1,2-b]indazol-2-one Openeye Name: 6-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4-methyl-pyrimido[1,2-b]indazol-2-one CAS Name: 4-methyl-6-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-pyrimido[1,2-b]indazolone IUPAC Name: 6-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-4-methylpyrimido[1,2-b]indazol-2-one Traditional Name: 6-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-4-methyl-pyrimid[1,2-b]indazol-2-one Formula: C24H26N5O2+ MolecularWeight: 416.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)N4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)CC(=O)N4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H25N5O2/c1-18-15-22(30)25-24-20-9-5-6-10-21(20)28(29(18)24)17-23(31)27-13-11-26(12-14-27)16-19-7-3-2-4-8-19/h2-10,15H,11-14,16-17H2,1H3/p+1