4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzamide

Systemtic Name: 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzamide Openeye Name: 4-(2-methyl-4-oxo-quinazolin-3-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzamide CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]benzamide IUPAC Name: 4-(2-methyl-4-oxoquinazolin-3-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]benzamide Traditional Name: 4-(4-keto-2-methyl-quinazolin-3-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]benzamide Formula: C28H29N4O3+ MolecularWeight: 469.55486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC(C[NH+]4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N[C@H](C[NH+]4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c1-20-29-25-10-6-5-9-24(25)28(34)32(20)23-13-11-22(12-14-23)27(33)30-26(21-7-3-2-4-8-21)19-31-15-17-35-18-16-31/h2-14,26H,15-19H2,1H3,(H,30,33)/p+1/t26-/m1/s1