1-indol-1-yl-4-[3-(pentan-3-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde

Systemtic Name: 1-indol-1-yl-4-[3-(pentan-3-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Openeye Name: 4-[3-(1-ethylpropylamino)-2-pyridyl]-1-indol-1-yl-piperazine-2-carbaldehyde CAS Name: 1-(1-indolyl)-4-[3-(pentan-3-ylamino)-2-pyridinyl]-2-piperazinecarboxaldehyde IUPAC Name: 1-indol-1-yl-4-[3-(pentan-3-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Traditional Name: 4-[3-(1-ethylpropylamino)-2-pyridyl]-1-indol-1-yl-piperazine-2-carbaldehyde Formula: C23H29N5O MolecularWeight: 391.50926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=CC=CC=C43

Isomeric SMILES

CCC(CC)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=CC=CC=C43

InChI

InChI=1S/C23H29N5O/c1-3-19(4-2)25-21-9-7-12-24-23(21)26-14-15-27(20(16-26)17-29)28-13-11-18-8-5-6-10-22(18)28/h5-13,17,19-20,25H,3-4,14-16H2,1-2H3