N-(3-methoxy-4-phenoxy-phenyl)-6-(3-methylbut-1-ynyl)quinazolin-4-amine

Systemtic Name: N-(3-methoxy-4-phenoxy-phenyl)-6-(3-methylbut-1-ynyl)quinazolin-4-amine Openeye Name: N-(3-methoxy-4-phenoxy-phenyl)-6-(3-methylbut-1-ynyl)quinazolin-4-amine CAS Name: N-(3-methoxy-4-phenoxyphenyl)-6-(3-methylbut-1-ynyl)-4-quinazolinamine IUPAC Name: N-(3-methoxy-4-phenoxyphenyl)-6-(3-methylbut-1-ynyl)quinazolin-4-amine Traditional Name: (3-methoxy-4-phenoxy-phenyl)-[6-(3-methylbut-1-ynyl)quinazolin-4-yl]amine Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC

InChI

InChI=1S/C26H23N3O2/c1-18(2)9-10-19-11-13-23-22(15-19)26(28-17-27-23)29-20-12-14-24(25(16-20)30-3)31-21-7-5-4-6-8-21/h4-8,11-18H,1-3H3,(H,27,28,29)