N-[(Z)-(4-imidazol-1-ylphenyl)methylideneamino]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: N-[(Z)-(4-imidazol-1-ylphenyl)methylideneamino]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[(Z)-(4-imidazol-1-ylphenyl)methyleneamino]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: N-[(Z)-[4-(1-imidazolyl)phenyl]methylideneamino]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-[(Z)-(4-imidazol-1-ylphenyl)methylideneamino]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: N-[(Z)-(4-imidazol-1-ylbenzylidene)amino]-9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C22H18N6O2 MolecularWeight: 398.41732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)NN=CC4=CC=C(C=C4)N5C=CN=C5)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)N/N=C\C4=CC=C(C=C4)N5C=CN=C5)C(=O)N2C1

InChI

InChI=1S/C22H18N6O2/c29-21(26-24-13-15-3-6-17(7-4-15)27-11-9-23-14-27)16-5-8-18-19(12-16)25-20-2-1-10-28(20)22(18)30/h3-9,11-14H,1-2,10H2,(H,26,29)/b24-13-