1-(5-azanylindol-1-yl)-4-[3-(tert-butylamino)pyridin-2-yl]piperazine-2-carbaldehyde

Systemtic Name: 1-(5-azanylindol-1-yl)-4-[3-(tert-butylamino)pyridin-2-yl]piperazine-2-carbaldehyde Openeye Name: 1-(5-aminoindol-1-yl)-4-[3-(tert-butylamino)-2-pyridyl]piperazine-2-carbaldehyde CAS Name: 1-(5-amino-1-indolyl)-4-[3-(tert-butylamino)-2-pyridinyl]-2-piperazinecarboxaldehyde IUPAC Name: 1-(5-aminoindol-1-yl)-4-[3-(tert-butylamino)pyridin-2-yl]piperazine-2-carbaldehyde Traditional Name: 1-(5-aminoindol-1-yl)-4-[3-(tert-butylamino)-2-pyridyl]piperazine-2-carbaldehyde Formula: C22H28N6O MolecularWeight: 392.49732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)N

Isomeric SMILES

CC(C)(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)N

InChI

InChI=1S/C22H28N6O/c1-22(2,3)25-19-5-4-9-24-21(19)26-11-12-27(18(14-26)15-29)28-10-8-16-13-17(23)6-7-20(16)28/h4-10,13,15,18,25H,11-12,14,23H2,1-3H3