N-[3-(4-tert-butylphenoxy)propyl]-6-iodanyl-quinazolin-4-amine

Systemtic Name: N-[3-(4-tert-butylphenoxy)propyl]-6-iodanyl-quinazolin-4-amine Openeye Name: N-[3-(4-tert-butylphenoxy)propyl]-6-iodo-quinazolin-4-amine CAS Name: N-[3-(4-tert-butylphenoxy)propyl]-6-iodo-4-quinazolinamine IUPAC Name: N-[3-(4-tert-butylphenoxy)propyl]-6-iodoquinazolin-4-amine Traditional Name: 3-(4-tert-butylphenoxy)propyl-(6-iodoquinazolin-4-yl)amine Formula: C21H24IN3O MolecularWeight: 461.33923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCNC2=NC=NC3=C2C=C(C=C3)I

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCNC2=NC=NC3=C2C=C(C=C3)I

InChI

InChI=1S/C21H24IN3O/c1-21(2,3)15-5-8-17(9-6-15)26-12-4-11-23-20-18-13-16(22)7-10-19(18)24-14-25-20/h5-10,13-14H,4,11-12H2,1-3H3,(H,23,24,25)