N-[2-[4-[bis(pyridin-4-ylmethyl)amino]piperidin-1-yl]ethyl]-7-chloranyl-quinolin-4-amine

Systemtic Name: N-[2-[4-[bis(pyridin-4-ylmethyl)amino]piperidin-1-yl]ethyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[2-[4-[bis(4-pyridylmethyl)amino]-1-piperidyl]ethyl]-7-chloro-quinolin-4-amine CAS Name: N-[2-[4-[bis(pyridin-4-ylmethyl)amino]-1-piperidinyl]ethyl]-7-chloro-4-quinolinamine IUPAC Name: N-[2-[4-[bis(pyridin-4-ylmethyl)amino]piperidin-1-yl]ethyl]-7-chloroquinolin-4-amine Traditional Name: [1-[2-[(7-chloro-4-quinolyl)amino]ethyl]-4-piperidyl]-bis(4-pyridylmethyl)amine Formula: C28H31ClN6 MolecularWeight: 487.03894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CC2=CC=NC=C2)CC3=CC=NC=C3)CCNC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1CN(CCC1N(CC2=CC=NC=C2)CC3=CC=NC=C3)CCNC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C28H31ClN6/c29-24-1-2-26-27(7-14-32-28(26)19-24)33-15-18-34-16-8-25(9-17-34)35(20-22-3-10-30-11-4-22)21-23-5-12-31-13-6-23/h1-7,10-14,19,25H,8-9,15-18,20-21H2,(H,32,33)