4-[4-[(3-chloranyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]but-3-ynamide

Systemtic Name: 4-[4-[(3-chloranyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]but-3-ynamide Openeye Name: 4-[4-[3-chloro-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-ynamide CAS Name: 4-[4-[3-chloro-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]-3-butynamide IUPAC Name: 4-[4-(3-chloro-4-pyridin-3-yloxyanilino)quinazolin-6-yl]but-3-ynamide Traditional Name: 4-[4-[3-chloro-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-ynamide Formula: C23H16ClN5O2 MolecularWeight: 429.85844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCC(=O)N)Cl

Isomeric SMILES

C1=CC(=CN=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCC(=O)N)Cl

InChI

InChI=1S/C23H16ClN5O2/c24-19-12-16(7-9-21(19)31-17-4-2-10-26-13-17)29-23-18-11-15(3-1-5-22(25)30)6-8-20(18)27-14-28-23/h2,4,6-14H,5H2,(H2,25,30)(H,27,28,29)