[(1R)-1-phenylethyl] (2R,3S)-1-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-aziridine-2-carboxylate

Systemtic Name: [(1R)-1-phenylethyl] (2R,3S)-1-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-aziridine-2-carboxylate Openeye Name: [(1R)-1-phenylethyl] (2R,3S)-1-(2-ethyl-4-oxo-quinazolin-3-yl)-3-methyl-aziridine-2-carboxylate CAS Name: (2R,3S)-1-(2-ethyl-4-oxo-3-quinazolinyl)-3-methyl-2-aziridinecarboxylic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] (2R,3S)-1-(2-ethyl-4-oxoquinazolin-3-yl)-3-methylaziridine-2-carboxylate Traditional Name: (2R,3S)-1-(2-ethyl-4-keto-quinazolin-3-yl)-3-methyl-ethylenimine-2-carboxylic acid [(1R)-1-phenylethyl] ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1N3C(C3C(=O)OC(C)C4=CC=CC=C4)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1N3[C@H]([C@@H]3C(=O)O[C@H](C)C4=CC=CC=C4)C

InChI

InChI=1S/C22H23N3O3/c1-4-19-23-18-13-9-8-12-17(18)21(26)25(19)24-14(2)20(24)22(27)28-15(3)16-10-6-5-7-11-16/h5-15,20H,4H2,1-3H3/t14-,15+,20+,24?/m0/s1