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

Systemtic Name: methyl (2R,3S)-3-ethyl-1-[2-(2-methylpropyl)-4-oxidanylidene-quinazolin-3-yl]-3-phenyl-aziridine-2-carboxylate Openeye Name: methyl (2R,3S)-3-ethyl-1-(2-isobutyl-4-oxo-quinazolin-3-yl)-3-phenyl-aziridine-2-carboxylate CAS Name: (2R,3S)-3-ethyl-1-[2-(2-methylpropyl)-4-oxo-3-quinazolinyl]-3-phenyl-2-aziridinecarboxylic acid methyl ester IUPAC Name: methyl (2R,3S)-3-ethyl-1-[2-(2-methylpropyl)-4-oxoquinazolin-3-yl]-3-phenylaziridine-2-carboxylate Traditional Name: (2R,3S)-3-ethyl-1-(2-isobutyl-4-keto-quinazolin-3-yl)-3-phenyl-ethylenimine-2-carboxylic acid methyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N1N2C(=NC3=CC=CC=C3C2=O)CC(C)C)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC[C@@]1([C@@H](N1N2C(=NC3=CC=CC=C3C2=O)CC(C)C)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3/c1-5-24(17-11-7-6-8-12-17)21(23(29)30-4)27(24)26-20(15-16(2)3)25-19-14-10-9-13-18(19)22(26)28/h6-14,16,21H,5,15H2,1-4H3/t21-,24-,27?/m0/s1