3-[[(2S)-2-azido-2-phenyl-ethyl]amino]-2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]quinazolin-4-one

Systemtic Name: 3-[[(2S)-2-azido-2-phenyl-ethyl]amino]-2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]quinazolin-4-one Openeye Name: 3-[[(2S)-2-azido-2-phenyl-ethyl]amino]-2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]quinazolin-4-one CAS Name: 3-[[(2S)-2-azido-2-phenylethyl]amino]-2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-4-quinazolinone IUPAC Name: 3-[[(2S)-2-azido-2-phenylethyl]amino]-2-[(1S)-1-hydroxy-2,2-dimethylpropyl]quinazolin-4-one Traditional Name: 3-[[(2S)-2-azido-2-phenyl-ethyl]amino]-2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]quinazolin-4-one Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=NC2=CC=CC=C2C(=O)N1NCC(C3=CC=CC=C3)N=[N+]=[N-])O

Isomeric SMILES

CC(C)(C)[C@@H](C1=NC2=CC=CC=C2C(=O)N1NC[C@H](C3=CC=CC=C3)N=[N+]=[N-])O

InChI

InChI=1S/C21H24N6O2/c1-21(2,3)18(28)19-24-16-12-8-7-11-15(16)20(29)27(19)23-13-17(25-26-22)14-9-5-4-6-10-14/h4-12,17-18,23,28H,13H2,1-3H3/t17-,18-/m1/s1