6-(1,3-benzodioxol-5-yl)-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]pyridazin-3-amine

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]pyridazin-3-amine Openeye Name: 6-(1,3-benzodioxol-5-yl)-N-[2-(1-benzyl-4-piperidyl)ethyl]pyridazin-3-amine CAS Name: 6-(1,3-benzodioxol-5-yl)-N-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]-3-pyridazinamine IUPAC Name: 6-(1,3-benzodioxol-5-yl)-N-[2-(1-benzylpiperidin-4-yl)ethyl]pyridazin-3-amine Traditional Name: [6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-[2-(1-benzyl-4-piperidyl)ethyl]amine Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CCNC2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C25H28N4O2/c1-2-4-20(5-3-1)17-29-14-11-19(12-15-29)10-13-26-25-9-7-22(27-28-25)21-6-8-23-24(16-21)31-18-30-23/h1-9,16,19H,10-15,17-18H2,(H,26,28)