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

Systemtic Name: N-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]quinazolin-6-yl]-1-prop-2-enoyl-piperidine-4-carboxamide Openeye Name: N-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-6-yl]-1-prop-2-enoyl-piperidine-4-carboxamide CAS Name: N-[4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-6-quinazolinyl]-1-(1-oxoprop-2-enyl)-4-piperidinecarboxamide IUPAC Name: N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]quinazolin-6-yl]-1-prop-2-enoylpiperidine-4-carboxamide Traditional Name: 1-acryloyl-N-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-6-yl]isonipecotamide Formula: C29H27ClN6O3 MolecularWeight: 543.01608

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

Isomeric SMILES

C=CC(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

InChI

InChI=1S/C29H27ClN6O3/c1-2-27(37)36-13-10-19(11-14-36)29(38)35-20-6-8-25-23(15-20)28(33-18-32-25)34-21-7-9-26(24(30)16-21)39-17-22-5-3-4-12-31-22/h2-9,12,15-16,18-19H,1,10-11,13-14,17H2,(H,35,38)(H,32,33,34)