(2S)-2-[[(2S,3S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[[(2S,3S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[[(2S,3S)-3-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(2S,3S)-3-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)pentyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[[(2S,3S)-3-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(2S,3S)-2-(4-ketoquinazolin-3-yl)-3-methyl-pentanoyl]amino]-2-phenyl-acetate Formula: C22H22N3O4- MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C1=CC=CC=C1)C(=O)[O-])N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C1=CC=CC=C1)C(=O)[O-])N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23N3O4/c1-3-14(2)19(25-13-23-17-12-8-7-11-16(17)21(25)27)20(26)24-18(22(28)29)15-9-5-4-6-10-15/h4-14,18-19H,3H2,1-2H3,(H,24,26)(H,28,29)/p-1/t14-,18-,19-/m0/s1