[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]ammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]azanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)[NH2+]CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)[NH2+]CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C23H28N4O2/c1-4-16-9-11-17(12-10-16)22(15(2)3)25-13-21-26-19-8-6-5-7-18(19)23(29)27(21)14-20(24)28/h5-12,15,22,25H,4,13-14H2,1-3H3,(H2,24,28)/p+1/t22-/m0/s1