N-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]quinazolin-6-yl]-1-prop-2-enoyl-azetidine-3-carboxamide

Systemtic Name: N-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]quinazolin-6-yl]-1-prop-2-enoyl-azetidine-3-carboxamide Openeye Name: N-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-6-yl]-1-prop-2-enoyl-azetidine-3-carboxamide CAS Name: N-[4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-6-quinazolinyl]-1-(1-oxoprop-2-enyl)-3-azetidinecarboxamide IUPAC Name: N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]quinazolin-6-yl]-1-prop-2-enoylazetidine-3-carboxamide Traditional Name: 1-acryloyl-N-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-6-yl]azetidine-3-carboxamide Formula: C27H23ClN6O3 MolecularWeight: 514.96292

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N1CC(C1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

Isomeric SMILES

C=CC(=O)N1CC(C1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

InChI

InChI=1S/C27H23ClN6O3/c1-2-25(35)34-13-17(14-34)27(36)33-18-6-8-23-21(11-18)26(31-16-30-23)32-19-7-9-24(22(28)12-19)37-15-20-5-3-4-10-29-20/h2-12,16-17H,1,13-15H2,(H,33,36)(H,30,31,32)