2-chloranyl-N-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-amine

Systemtic Name: 2-chloranyl-N-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-amine Openeye Name: 2-chloro-N-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-amine CAS Name: 2-chloro-N-[2-(3,5-dimethylphenoxy)ethyl]-4-quinazolinamine IUPAC Name: 2-chloro-N-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-amine Traditional Name: (2-chloroquinazolin-4-yl)-[2-(3,5-dimethylphenoxy)ethyl]amine Formula: C18H18ClN3O MolecularWeight: 327.80802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=NC(=NC3=CC=CC=C32)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=NC(=NC3=CC=CC=C32)Cl)C

InChI

InChI=1S/C18H18ClN3O/c1-12-9-13(2)11-14(10-12)23-8-7-20-17-15-5-3-4-6-16(15)21-18(19)22-17/h3-6,9-11H,7-8H2,1-2H3,(H,20,21,22)