6-bromanyl-7-(4-chloranylphenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine

Systemtic Name: 6-bromanyl-7-(4-chloranylphenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine Openeye Name: 6-bromo-7-(4-chlorophenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine CAS Name: 6-bromo-7-(4-chlorophenoxy)-N-(3-ethynylphenyl)-4-quinazolinamine IUPAC Name: 6-bromo-7-(4-chlorophenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine Traditional Name: [6-bromo-7-(4-chlorophenoxy)quinazolin-4-yl]-(3-ethynylphenyl)amine Formula: C22H13BrClN3O MolecularWeight: 450.71512

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)Br)OC4=CC=C(C=C4)Cl

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)Br)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H13BrClN3O/c1-2-14-4-3-5-16(10-14)27-22-18-11-19(23)21(12-20(18)25-13-26-22)28-17-8-6-15(24)7-9-17/h1,3-13H,(H,25,26,27)