(2S,3R)-3-methyl-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]pentanoate

Systemtic Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]pentanoate Openeye Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-3-phenyl-propanoyl]amino]pentanoate CAS Name: (2S,3R)-3-methyl-2-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)-3-phenylpropyl]amino]pentanoate IUPAC Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-3-phenylpropanoyl]amino]pentanoate Traditional Name: (2S,3R)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)-3-phenyl-propanoyl]amino]-3-methyl-valerate Formula: C23H24N3O4- MolecularWeight: 406.45436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])NC(=O)[C@H](CC1=CC=CC=C1)N2C=NC3=CC=CC=C3C2=O

InChI

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