6-(3-azanylprop-1-ynyl)-N-(5-chloranyl-4-methyl-2-pyridin-3-yloxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-(3-azanylprop-1-ynyl)-N-(5-chloranyl-4-methyl-2-pyridin-3-yloxy-phenyl)quinazolin-4-amine Openeye Name: 6-(3-aminoprop-1-ynyl)-N-[5-chloro-4-methyl-2-(3-pyridyloxy)phenyl]quinazolin-4-amine CAS Name: 6-(3-aminoprop-1-ynyl)-N-[5-chloro-4-methyl-2-(3-pyridinyloxy)phenyl]-4-quinazolinamine IUPAC Name: 6-(3-aminoprop-1-ynyl)-N-(5-chloro-4-methyl-2-pyridin-3-yloxyphenyl)quinazolin-4-amine Traditional Name: [6-(3-aminoprop-1-ynyl)quinazolin-4-yl]-[5-chloro-4-methyl-2-(3-pyridyloxy)phenyl]amine Formula: C23H18ClN5O MolecularWeight: 415.87492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)NC2=NC=NC3=C2C=C(C=C3)C#CCN)OC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)NC2=NC=NC3=C2C=C(C=C3)C#CCN)OC4=CN=CC=C4

InChI

InChI=1S/C23H18ClN5O/c1-15-10-22(30-17-5-3-9-26-13-17)21(12-19(15)24)29-23-18-11-16(4-2-8-25)6-7-20(18)27-14-28-23/h3,5-7,9-14H,8,25H2,1H3,(H,27,28,29)