6-(3-azanylbut-1-ynyl)-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-(3-azanylbut-1-ynyl)-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine Openeye Name: 6-(3-aminobut-1-ynyl)-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine CAS Name: 6-(3-aminobut-1-ynyl)-N-(3-methyl-4-phenoxyphenyl)-4-quinazolinamine IUPAC Name: 6-(3-aminobut-1-ynyl)-N-(3-methyl-4-phenoxyphenyl)quinazolin-4-amine Traditional Name: [6-(3-aminobut-1-ynyl)quinazolin-4-yl]-(3-methyl-4-phenoxy-phenyl)amine Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N4O/c1-17-14-20(11-13-24(17)30-21-6-4-3-5-7-21)29-25-22-15-19(9-8-18(2)26)10-12-23(22)27-16-28-25/h3-7,10-16,18H,26H2,1-2H3,(H,27,28,29)