N-(4-tert-butylphenyl)-4-phthalazin-1-yl-piperazine-1-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-4-phthalazin-1-yl-piperazine-1-carboxamide Openeye Name: N-(4-tert-butylphenyl)-4-phthalazin-1-yl-piperazine-1-carboxamide CAS Name: N-(4-tert-butylphenyl)-4-(1-phthalazinyl)-1-piperazinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-4-phthalazin-1-ylpiperazine-1-carboxamide Traditional Name: N-(4-tert-butylphenyl)-4-phthalazin-1-yl-piperazine-1-carboxamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N5O/c1-23(2,3)18-8-10-19(11-9-18)25-22(29)28-14-12-27(13-15-28)21-20-7-5-4-6-17(20)16-24-26-21/h4-11,16H,12-15H2,1-3H3,(H,25,29)