(E)-N-[4-(isoquinolin-1-ylamino)quinazolin-6-yl]-4-oxidanylidene-pent-2-enamide

Systemtic Name: (E)-N-[4-(isoquinolin-1-ylamino)quinazolin-6-yl]-4-oxidanylidene-pent-2-enamide Openeye Name: (E)-N-[4-(1-isoquinolylamino)quinazolin-6-yl]-4-oxo-pent-2-enamide CAS Name: (E)-N-[4-(1-isoquinolinylamino)-6-quinazolinyl]-4-oxo-2-pentenamide IUPAC Name: (E)-N-[4-(isoquinolin-1-ylamino)quinazolin-6-yl]-4-oxopent-2-enamide Traditional Name: (E)-N-[4-(1-isoquinolylamino)quinazolin-6-yl]-4-keto-pent-2-enamide Formula: C22H17N5O2 MolecularWeight: 383.40268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=NC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)/C=C/C(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H17N5O2/c1-14(28)6-9-20(29)26-16-7-8-19-18(12-16)22(25-13-24-19)27-21-17-5-3-2-4-15(17)10-11-23-21/h2-13H,1H3,(H,26,29)(H,23,24,25,27)/b9-6+