N2-(4-fluorophenyl)-N4-(phenylmethyl)quinazoline-2,4-diamine hydrochloride

Systemtic Name: N2-(4-fluorophenyl)-N4-(phenylmethyl)quinazoline-2,4-diamine hydrochloride Openeye Name: N4-benzyl-N2-(4-fluorophenyl)quinazoline-2,4-diamine hydrochloride CAS Name: N2-(4-fluorophenyl)-N4-(phenylmethyl)quinazoline-2,4-diamine hydrochloride IUPAC Name: 4-N-benzyl-2-N-(4-fluorophenyl)quinazoline-2,4-diamine hydrochloride Traditional Name: benzyl-[2-(4-fluoroanilino)quinazolin-4-yl]amine hydrochloride Formula: C21H18ClFN4 MolecularWeight: 380.845823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)NC4=CC=C(C=C4)F.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)NC4=CC=C(C=C4)F.Cl

InChI

InChI=1S/C21H17FN4.ClH/c22-16-10-12-17(13-11-16)24-21-25-19-9-5-4-8-18(19)20(26-21)23-14-15-6-2-1-3-7-15;/h1-13H,14H2,(H2,23,24,25,26);1H