(2S,3S)-3-methyl-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanoic acid

Systemtic Name: (2S,3S)-3-methyl-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanoic acid Openeye Name: (2S,3S)-2-[(2-isopropylquinazolin-4-yl)amino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-3-methyl-2-[(2-propan-2-yl-4-quinazolinyl)amino]pentanoic acid IUPAC Name: (2S,3S)-3-methyl-2-[(2-propan-2-ylquinazolin-4-yl)amino]pentanoic acid Traditional Name: (2S,3S)-2-[(2-isopropylquinazolin-4-yl)amino]-3-methyl-valeric acid Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC1=NC(=NC2=CC=CC=C21)C(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC1=NC(=NC2=CC=CC=C21)C(C)C

InChI

InChI=1S/C17H23N3O2/c1-5-11(4)14(17(21)22)19-16-12-8-6-7-9-13(12)18-15(20-16)10(2)3/h6-11,14H,5H2,1-4H3,(H,21,22)(H,18,19,20)/t11-,14-/m0/s1