ethyl 4-[(4-bromanyl-2-methyl-phenyl)amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[(4-bromanyl-2-methyl-phenyl)amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-(4-bromo-2-methyl-anilino)quinazoline-2-carboxylate CAS Name: 4-(4-bromo-2-methylanilino)-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-2-methylanilino)quinazoline-2-carboxylate Traditional Name: 4-(4-bromo-2-methyl-anilino)quinazoline-2-carboxylic acid ethyl ester Formula: C18H16BrN3O2 MolecularWeight: 386.24254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C18H16BrN3O2/c1-3-24-18(23)17-21-15-7-5-4-6-13(15)16(22-17)20-14-9-8-12(19)10-11(14)2/h4-10H,3H2,1-2H3,(H,20,21,22)