N-[3-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide

Systemtic Name: N-[3-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide Openeye Name: N-[3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: N-[3-[4-(3-chloro-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]acetamide IUPAC Name: N-[3-[4-(3-chloro-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]acetamide Traditional Name: N-[3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C25H19ClN4O2 MolecularWeight: 442.89696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

CC(=O)NCC#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H19ClN4O2/c1-17(31)27-13-5-6-18-9-11-23-21(14-18)25(29-16-28-23)30-19-10-12-24(22(26)15-19)32-20-7-3-2-4-8-20/h2-4,7-12,14-16H,13H2,1H3,(H,27,31)(H,28,29,30)