6-chloranyl-N-(3-ethynylphenyl)quinazolin-4-amine

Systemtic Name: 6-chloranyl-N-(3-ethynylphenyl)quinazolin-4-amine Openeye Name: 6-chloro-N-(3-ethynylphenyl)quinazolin-4-amine CAS Name: 6-chloro-N-(3-ethynylphenyl)-4-quinazolinamine IUPAC Name: 6-chloro-N-(3-ethynylphenyl)quinazolin-4-amine Traditional Name: (6-chloroquinazolin-4-yl)-(3-ethynylphenyl)amine Formula: C16H10ClN3 MolecularWeight: 279.7237

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClN3/c1-2-11-4-3-5-13(8-11)20-16-14-9-12(17)6-7-15(14)18-10-19-16/h1,3-10H,(H,18,19,20)