N,N-dimethyl-4-[3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoylamino]benzamide

Systemtic Name: N,N-dimethyl-4-[3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoylamino]benzamide Openeye Name: N,N-dimethyl-4-[3-[1-oxo-4-(p-tolyl)phthalazin-2-yl]propanoylamino]benzamide CAS Name: N,N-dimethyl-4-[[3-[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]-1-oxopropyl]amino]benzamide IUPAC Name: N,N-dimethyl-4-[3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoylamino]benzamide Traditional Name: 4-[3-[1-keto-4-(p-tolyl)phthalazin-2-yl]propanoylamino]-N,N-dimethyl-benzamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)C(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)C(=O)N(C)C

InChI

InChI=1S/C27H26N4O3/c1-18-8-10-19(11-9-18)25-22-6-4-5-7-23(22)27(34)31(29-25)17-16-24(32)28-21-14-12-20(13-15-21)26(33)30(2)3/h4-15H,16-17H2,1-3H3,(H,28,32)