4-[4-[[4-[(2,5-dimethylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]benzamide

Systemtic Name: 4-[4-[[4-[(2,5-dimethylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]benzamide Openeye Name: 4-[4-[4-[(2,5-dimethylphenyl)carbamoyl]anilino]phthalazin-1-yl]benzamide CAS Name: 4-[4-[4-[(2,5-dimethylanilino)-oxomethyl]anilino]-1-phthalazinyl]benzamide IUPAC Name: 4-[4-[4-[(2,5-dimethylphenyl)carbamoyl]anilino]phthalazin-1-yl]benzamide Traditional Name: 4-[4-[4-[(2,5-dimethylphenyl)carbamoyl]anilino]phthalazin-1-yl]benzamide Formula: C30H25N5O2 MolecularWeight: 487.5518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)C(=O)N

InChI

InChI=1S/C30H25N5O2/c1-18-7-8-19(2)26(17-18)33-30(37)22-13-15-23(16-14-22)32-29-25-6-4-3-5-24(25)27(34-35-29)20-9-11-21(12-10-20)28(31)36/h3-17H,1-2H3,(H2,31,36)(H,32,35)(H,33,37)