2-[[4-[(6-bromanylquinazolin-4-yl)amino]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(6-bromanylquinazolin-4-yl)amino]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[(6-bromoquinazolin-4-yl)amino]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[(6-bromo-4-quinazolinyl)amino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[(6-bromoquinazolin-4-yl)amino]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[(6-bromoquinazolin-4-yl)amino]benzoyl]amino]acetic acid Formula: C17H13BrN4O3 MolecularWeight: 401.21412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)O)NC2=NC=NC3=C2C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)O)NC2=NC=NC3=C2C=C(C=C3)Br

InChI

InChI=1S/C17H13BrN4O3/c18-11-3-6-14-13(7-11)16(21-9-20-14)22-12-4-1-10(2-5-12)17(25)19-8-15(23)24/h1-7,9H,8H2,(H,19,25)(H,23,24)(H,20,21,22)