N,N-diethyl-4-[4-[[4-[(2-methylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]benzamide

Systemtic Name: N,N-diethyl-4-[4-[[4-[(2-methylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]benzamide Openeye Name: N,N-diethyl-4-[4-[4-(o-tolylcarbamoyl)anilino]phthalazin-1-yl]benzamide CAS Name: N,N-diethyl-4-[4-[4-[(2-methylanilino)-oxomethyl]anilino]-1-phthalazinyl]benzamide IUPAC Name: N,N-diethyl-4-[4-[4-[(2-methylphenyl)carbamoyl]anilino]phthalazin-1-yl]benzamide Traditional Name: N,N-diethyl-4-[4-[4-(o-tolylcarbamoyl)anilino]phthalazin-1-yl]benzamide Formula: C33H31N5O2 MolecularWeight: 529.63154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5C

InChI

InChI=1S/C33H31N5O2/c1-4-38(5-2)33(40)25-16-14-23(15-17-25)30-27-11-7-8-12-28(27)31(37-36-30)34-26-20-18-24(19-21-26)32(39)35-29-13-9-6-10-22(29)3/h6-21H,4-5H2,1-3H3,(H,34,37)(H,35,39)