cyclopropyl-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-[(4-phenylquinazolin-2-yl)methyl]azanium

Systemtic Name: cyclopropyl-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-[(4-phenylquinazolin-2-yl)methyl]azanium Openeye Name: cyclopropyl-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-[(4-phenylquinazolin-2-yl)methyl]ammonium CAS Name: cyclopropyl-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-[(4-phenyl-2-quinazolinyl)methyl]ammonium IUPAC Name: cyclopropyl-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-[(4-phenylquinazolin-2-yl)methyl]azanium Traditional Name: cyclopropyl-[4-(cyclopropylcarbamoyl)benzyl]-[(4-phenylquinazolin-2-yl)methyl]ammonium Formula: C29H29N4O+ MolecularWeight: 449.56676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5)C6CC6

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5)C6CC6

InChI

InChI=1S/C29H28N4O/c34-29(30-23-14-15-23)22-12-10-20(11-13-22)18-33(24-16-17-24)19-27-31-26-9-5-4-8-25(26)28(32-27)21-6-2-1-3-7-21/h1-13,23-24H,14-19H2,(H,30,34)/p+1