butyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: butyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: [2-(benzylamino)-2-oxo-ethyl]-butyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[2-oxo-2-[(phenylmethyl)amino]ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: [2-(benzylamino)-2-oxoethyl]-butyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [2-(benzylamino)-2-keto-ethyl]-butyl-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c1-2-3-13-26(16-21(27)23-14-17-9-5-4-6-10-17)15-20-24-19-12-8-7-11-18(19)22(28)25-20/h4-12H,2-3,13-16H2,1H3,(H,23,27)(H,24,25,28)/p+1