4-[4-[(4-aminocarbonylphenyl)amino]phthalazin-1-yl]benzamide

Systemtic Name: 4-[4-[(4-aminocarbonylphenyl)amino]phthalazin-1-yl]benzamide Openeye Name: 4-[4-(4-carbamoylanilino)phthalazin-1-yl]benzamide CAS Name: 4-[4-(4-carbamoylanilino)-1-phthalazinyl]benzamide IUPAC Name: 4-[4-(4-carbamoylanilino)phthalazin-1-yl]benzamide Traditional Name: 4-[4-(4-carbamoylanilino)phthalazin-1-yl]benzamide Formula: C22H17N5O2 MolecularWeight: 383.40268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)C(=O)N)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)C(=O)N)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H17N5O2/c23-20(28)14-7-5-13(6-8-14)19-17-3-1-2-4-18(17)22(27-26-19)25-16-11-9-15(10-12-16)21(24)29/h1-12H,(H2,23,28)(H2,24,29)(H,25,27)