4-[4-[(3-chlorophenyl)amino]phthalazin-1-yl]-N,N-diethyl-benzamide

Systemtic Name: 4-[4-[(3-chlorophenyl)amino]phthalazin-1-yl]-N,N-diethyl-benzamide Openeye Name: 4-[4-(3-chloroanilino)phthalazin-1-yl]-N,N-diethyl-benzamide CAS Name: 4-[4-(3-chloroanilino)-1-phthalazinyl]-N,N-diethylbenzamide IUPAC Name: 4-[4-(3-chloroanilino)phthalazin-1-yl]-N,N-diethylbenzamide Traditional Name: 4-[4-(3-chloroanilino)phthalazin-1-yl]-N,N-diethyl-benzamide Formula: C25H23ClN4O MolecularWeight: 430.92932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H23ClN4O/c1-3-30(4-2)25(31)18-14-12-17(13-15-18)23-21-10-5-6-11-22(21)24(29-28-23)27-20-9-7-8-19(26)16-20/h5-16H,3-4H2,1-2H3,(H,27,29)