4-[4-(tert-butylamino)-1H-pyridazin-2-yl]-1-(5-phenylmethoxyindol-1-yl)piperazine-2-carbaldehyde

Systemtic Name: 4-[4-(tert-butylamino)-1H-pyridazin-2-yl]-1-(5-phenylmethoxyindol-1-yl)piperazine-2-carbaldehyde Openeye Name: 1-(5-benzyloxyindol-1-yl)-4-[4-(tert-butylamino)-1H-pyridazin-2-yl]piperazine-2-carbaldehyde CAS Name: 4-[4-(tert-butylamino)-1H-pyridazin-2-yl]-1-(5-phenylmethoxy-1-indolyl)-2-piperazinecarboxaldehyde IUPAC Name: 4-[4-(tert-butylamino)-1H-pyridazin-2-yl]-1-(5-phenylmethoxyindol-1-yl)piperazine-2-carbaldehyde Traditional Name: 1-(5-benzoxyindol-1-yl)-4-[4-(tert-butylamino)-1H-pyridazin-2-yl]piperazine-2-carbaldehyde Formula: C28H34N6O2 MolecularWeight: 486.60856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=CN(NC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)NC1=CN(NC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H34N6O2/c1-28(2,3)30-24-11-13-29-34(18-24)31-15-16-32(25(19-31)20-35)33-14-12-23-17-26(9-10-27(23)33)36-21-22-7-5-4-6-8-22/h4-14,17-18,20,25,29-30H,15-16,19,21H2,1-3H3