2-diethylaminoethyl 4-[(6-bromanylquinazolin-4-yl)amino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(6-bromanylquinazolin-4-yl)amino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate CAS Name: 4-[(6-bromo-4-quinazolinyl)amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate Traditional Name: 4-[(6-bromoquinazolin-4-yl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C21H23BrN4O2 MolecularWeight: 443.33692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN4O2/c1-3-26(4-2)11-12-28-21(27)15-5-8-17(9-6-15)25-20-18-13-16(22)7-10-19(18)23-14-24-20/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,23,24,25)