(2S)-2-[[(2S)-2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-methyl-butanoyl]amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[[(2S)-2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-methyl-butanoyl]amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methyl-butanoyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methyl-1-oxobutyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methylbutanoyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(2S)-2-(2,4-diketo-1H-quinazolin-3-yl)-3-methyl-butanoyl]amino]-2-phenyl-acetate Formula: C21H20N3O5- MolecularWeight: 394.4006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C1=CC=CC=C1)C(=O)[O-])N2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](C1=CC=CC=C1)C(=O)[O-])N2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H21N3O5/c1-12(2)17(18(25)23-16(20(27)28)13-8-4-3-5-9-13)24-19(26)14-10-6-7-11-15(14)22-21(24)29/h3-12,16-17H,1-2H3,(H,22,29)(H,23,25)(H,27,28)/p-1/t16-,17-/m0/s1