pentyl 4-[(6-bromanylquinazolin-4-yl)amino]benzoate

Systemtic Name: pentyl 4-[(6-bromanylquinazolin-4-yl)amino]benzoate Openeye Name: pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate CAS Name: 4-[(6-bromo-4-quinazolinyl)amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate Traditional Name: 4-[(6-bromoquinazolin-4-yl)amino]benzoic acid amyl ester Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrN3O2/c1-2-3-4-11-26-20(25)14-5-8-16(9-6-14)24-19-17-12-15(21)7-10-18(17)22-13-23-19/h5-10,12-13H,2-4,11H2,1H3,(H,22,23,24)