[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C1=NC(=O)C2=CC=CC=C2N1)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)OC(=O)[C@H](C(C)C)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-14(2)20(25-19(27)13-16-9-5-4-6-10-16)23(29)30-15(3)21-24-18-12-8-7-11-17(18)22(28)26-21/h4-12,14-15,20H,13H2,1-3H3,(H,25,27)(H,24,26,28)/t15-,20+/m1/s1