N-[3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-N-ethyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-N-ethyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-(4-carbamoylanilino)-3-oxo-propyl]-N-ethyl-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-(4-carbamoylanilino)-3-oxopropyl]-N-ethyl-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-(4-carbamoylanilino)-3-oxopropyl]-N-ethyl-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[3-(4-carbamoylanilino)-3-keto-propyl]-N-ethyl-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H25N5O4 MolecularWeight: 483.5185

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C27H25N5O4/c1-2-31(17-16-23(33)29-19-14-12-18(13-15-19)25(28)34)27(36)24-21-10-6-7-11-22(21)26(35)32(30-24)20-8-4-3-5-9-20/h3-15H,2,16-17H2,1H3,(H2,28,34)(H,29,33)