6-[3,4-bis(chloranyl)phenoxy]-N-(3-ethynylphenyl)quinazolin-4-amine

Systemtic Name: 6-[3,4-bis(chloranyl)phenoxy]-N-(3-ethynylphenyl)quinazolin-4-amine Openeye Name: 6-(3,4-dichlorophenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine CAS Name: 6-(3,4-dichlorophenoxy)-N-(3-ethynylphenyl)-4-quinazolinamine IUPAC Name: 6-(3,4-dichlorophenoxy)-N-(3-ethynylphenyl)quinazolin-4-amine Traditional Name: [6-(3,4-dichlorophenoxy)quinazolin-4-yl]-(3-ethynylphenyl)amine Formula: C22H13Cl2N3O MolecularWeight: 406.26412

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H13Cl2N3O/c1-2-14-4-3-5-15(10-14)27-22-18-11-16(7-9-21(18)25-13-26-22)28-17-6-8-19(23)20(24)12-17/h1,3-13H,(H,25,26,27)