4-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]butanamide

Systemtic Name: 4-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]butanamide Openeye Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]butanamide CAS Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]butanamide IUPAC Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]butyramide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O2/c30-23(12-6-11-22-26-21-10-5-4-9-20(21)24(31)27-22)25-13-14-28-15-17-29(18-16-28)19-7-2-1-3-8-19/h1-5,7-10H,6,11-18H2,(H,25,30)(H,26,27,31)/p+1