N,N-diethyl-3-[[6-[2-(3-oxidanylpiperidin-3-yl)ethynyl]quinazolin-4-yl]amino]benzamide

Systemtic Name: N,N-diethyl-3-[[6-[2-(3-oxidanylpiperidin-3-yl)ethynyl]quinazolin-4-yl]amino]benzamide Openeye Name: N,N-diethyl-3-[[6-[2-(3-hydroxy-3-piperidyl)ethynyl]quinazolin-4-yl]amino]benzamide CAS Name: N,N-diethyl-3-[[6-[2-(3-hydroxy-3-piperidinyl)ethynyl]-4-quinazolinyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[6-[2-(3-hydroxypiperidin-3-yl)ethynyl]quinazolin-4-yl]amino]benzamide Traditional Name: N,N-diethyl-3-[[6-[2-(3-hydroxy-3-piperidyl)ethynyl]quinazolin-4-yl]amino]benzamide Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC4(CCCNC4)O

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC4(CCCNC4)O

InChI

InChI=1S/C26H29N5O2/c1-3-31(4-2)25(32)20-7-5-8-21(16-20)30-24-22-15-19(9-10-23(22)28-18-29-24)11-13-26(33)12-6-14-27-17-26/h5,7-10,15-16,18,27,33H,3-4,6,12,14,17H2,1-2H3,(H,28,29,30)