4-[1-[2,6-bis(chloranyl)phenyl]-5-(2-chloranyl-4-fluoranyl-phenyl)-2-oxidanylidene-3,4-dihydroquinazolin-7-yl]piperidine-1-carboximidamide

Systemtic Name: 4-[1-[2,6-bis(chloranyl)phenyl]-5-(2-chloranyl-4-fluoranyl-phenyl)-2-oxidanylidene-3,4-dihydroquinazolin-7-yl]piperidine-1-carboximidamide Openeye Name: 4-[5-(2-chloro-4-fluoro-phenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]piperidine-1-carboxamidine CAS Name: 4-[5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]-1-piperidinecarboximidamide IUPAC Name: 4-[5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]piperidine-1-carboximidamide Traditional Name: 4-[5-(2-chloro-4-fluoro-phenyl)-1-(2,6-dichlorophenyl)-2-keto-3,4-dihydroquinazolin-7-yl]piperidine-1-carboxamidine Formula: C26H23Cl3FN5O MolecularWeight: 546.851123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC3=C(CNC(=O)N3C4=C(C=CC=C4Cl)Cl)C(=C2)C5=C(C=C(C=C5)F)Cl)C(=N)N

Isomeric SMILES

C1CN(CCC1C2=CC3=C(CNC(=O)N3C4=C(C=CC=C4Cl)Cl)C(=C2)C5=C(C=C(C=C5)F)Cl)C(=N)N

InChI

InChI=1S/C26H23Cl3FN5O/c27-20-2-1-3-21(28)24(20)35-23-11-15(14-6-8-34(9-7-14)25(31)32)10-18(19(23)13-33-26(35)36)17-5-4-16(30)12-22(17)29/h1-5,10-12,14H,6-9,13H2,(H3,31,32)(H,33,36)