(E)-N-[4-(6-ethynyl-2,3-dihydroindol-1-yl)quinazolin-6-yl]but-2-enamide

Systemtic Name: (E)-N-[4-(6-ethynyl-2,3-dihydroindol-1-yl)quinazolin-6-yl]but-2-enamide Openeye Name: (E)-N-[4-(6-ethynylindolin-1-yl)quinazolin-6-yl]but-2-enamide CAS Name: (E)-N-[4-(6-ethynyl-2,3-dihydroindol-1-yl)-6-quinazolinyl]-2-butenamide IUPAC Name: (E)-N-[4-(6-ethynyl-2,3-dihydroindol-1-yl)quinazolin-6-yl]but-2-enamide Traditional Name: (E)-N-[4-(6-ethynylindolin-1-yl)quinazolin-6-yl]but-2-enamide Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=CC2=C(C=C1)N=CN=C2N3CCC4=C3C=C(C=C4)C#C

Isomeric SMILES

C/C=C/C(=O)NC1=CC2=C(C=C1)N=CN=C2N3CCC4=C3C=C(C=C4)C#C

InChI

InChI=1S/C22H18N4O/c1-3-5-21(27)25-17-8-9-19-18(13-17)22(24-14-23-19)26-11-10-16-7-6-15(4-2)12-20(16)26/h2-3,5-9,12-14H,10-11H2,1H3,(H,25,27)/b5-3+