(4-oxidanylidene-1H-quinazolin-2-yl)methyl (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl (2S)-2-[(2-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-ethoxybenzoyl)amino]-3-methyl-butyric acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C23H25N3O5/c1-4-30-18-12-8-6-10-16(18)22(28)26-20(14(2)3)23(29)31-13-19-24-17-11-7-5-9-15(17)21(27)25-19/h5-12,14,20H,4,13H2,1-3H3,(H,26,28)(H,24,25,27)/t20-/m0/s1