N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(4-tert-butylphenyl)-4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C(C)(C)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C(C)(C)C)C)C

InChI

InChI=1S/C28H35N5O/c1-19-17-21(3)24(18-20(19)2)25-11-12-26(31-30-25)32-13-15-33(16-14-32)27(34)29-23-9-7-22(8-10-23)28(4,5)6/h7-12,17-18H,13-16H2,1-6H3,(H,29,34)