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

Systemtic Name: N-[(E)-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]methylideneamino]-2-piperidin-1-yl-ethanamide Openeye Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methyleneamino]-2-(1-piperidyl)acetamide CAS Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)-2-quinazolinyl]methylideneamino]-2-(1-piperidinyl)acetamide IUPAC Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methylideneamino]-2-piperidin-1-ylacetamide Traditional Name: N-[(E)-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]methyleneamino]-2-piperidino-acetamide Formula: C22H21BrClN5O MolecularWeight: 486.79204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(=O)NN=CC2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)CC(=O)N/N=C/C2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H21BrClN5O/c23-15-8-9-19-17(12-15)22(16-6-2-3-7-18(16)24)27-20(26-19)13-25-28-21(30)14-29-10-4-1-5-11-29/h2-3,6-9,12-13H,1,4-5,10-11,14H2,(H,28,30)/b25-13+