2-(3,3-dimethylbutan-2-yl)-3-(2-phenylaziridin-1-yl)quinazolin-4-one

Systemtic Name: 2-(3,3-dimethylbutan-2-yl)-3-(2-phenylaziridin-1-yl)quinazolin-4-one Openeye Name: 3-(2-phenylaziridin-1-yl)-2-(1,2,2-trimethylpropyl)quinazolin-4-one CAS Name: 2-(3,3-dimethylbutan-2-yl)-3-(2-phenyl-1-aziridinyl)-4-quinazolinone IUPAC Name: 2-(3,3-dimethylbutan-2-yl)-3-(2-phenylaziridin-1-yl)quinazolin-4-one Traditional Name: 3-(2-phenylethylenimin-1-yl)-2-(1,2,2-trimethylpropyl)quinazolin-4-one Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1N3CC3C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=O)N1N3CC3C4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C22H25N3O/c1-15(22(2,3)4)20-23-18-13-9-8-12-17(18)21(26)25(20)24-14-19(24)16-10-6-5-7-11-16/h5-13,15,19H,14H2,1-4H3