[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[2-(2-methylanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[2-(2-methylanilino)-2-oxoethyl]-propylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[2-(2-methylanilino)-2-oxoethyl]-propylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium Formula: C23H28N5O3+ MolecularWeight: 422.50012

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=NC2=CC=CC=C2C(=O)N1CC(=O)N)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCC[NH+](CC1=NC2=CC=CC=C2C(=O)N1CC(=O)N)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C23H27N5O3/c1-3-12-27(15-22(30)26-18-10-6-4-8-16(18)2)14-21-25-19-11-7-5-9-17(19)23(31)28(21)13-20(24)29/h4-11H,3,12-15H2,1-2H3,(H2,24,29)(H,26,30)/p+1