[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-(4-isopropylbenzyl)-methyl-ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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