N-[4-(2-methylpyridin-3-yl)oxyphenyl]-6-(2-piperidin-3-ylethynyl)quinazolin-4-amine

Systemtic Name: N-[4-(2-methylpyridin-3-yl)oxyphenyl]-6-(2-piperidin-3-ylethynyl)quinazolin-4-amine Openeye Name: N-[4-[(2-methyl-3-pyridyl)oxy]phenyl]-6-[2-(3-piperidyl)ethynyl]quinazolin-4-amine CAS Name: N-[4-[(2-methyl-3-pyridinyl)oxy]phenyl]-6-[2-(3-piperidinyl)ethynyl]-4-quinazolinamine IUPAC Name: N-[4-(2-methylpyridin-3-yl)oxyphenyl]-6-(2-piperidin-3-ylethynyl)quinazolin-4-amine Traditional Name: [4-[(2-methyl-3-pyridyl)oxy]phenyl]-[6-[2-(3-piperidyl)ethynyl]quinazolin-4-yl]amine Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)OC2=CC=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C#CC5CCCNC5

Isomeric SMILES

CC1=C(C=CC=N1)OC2=CC=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C#CC5CCCNC5

InChI

InChI=1S/C27H25N5O/c1-19-26(5-3-15-29-19)33-23-11-9-22(10-12-23)32-27-24-16-20(8-13-25(24)30-18-31-27)6-7-21-4-2-14-28-17-21/h3,5,8-13,15-16,18,21,28H,2,4,14,17H2,1H3,(H,30,31,32)