N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide CAS Name: N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide Traditional Name: 2,4-diketo-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-3-phenyl-1H-quinazoline-7-carboxamide Formula: C23H28N5O3+ MolecularWeight: 422.50012

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5O3/c1-26-12-14-27(15-13-26)11-5-10-24-21(29)17-8-9-19-20(16-17)25-23(31)28(22(19)30)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3,(H,24,29)(H,25,31)/p+1