N-[(E)-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]methylideneamino]-2-pyrrolidin-1-yl-ethanamide

Systemtic Name: N-[(E)-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]methylideneamino]-2-pyrrolidin-1-yl-ethanamide Openeye Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methyleneamino]-2-pyrrolidin-1-yl-acetamide CAS Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)-2-quinazolinyl]methylideneamino]-2-(1-pyrrolidinyl)acetamide IUPAC Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methylideneamino]-2-pyrrolidin-1-ylacetamide Traditional Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methyleneamino]-2-pyrrolidino-acetamide Formula: C21H19BrClN5O MolecularWeight: 472.76546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)NN=CC2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)CC(=O)N/N=C/C2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H19BrClN5O/c22-14-7-8-18-16(11-14)21(15-5-1-2-6-17(15)23)26-19(25-18)12-24-27-20(29)13-28-9-3-4-10-28/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,27,29)/b24-12+