N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-4-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-ethyl-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-homopiperonyl-amine Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C3=CC=NC=C3)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C3=CC=NC=C3)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H20N4O2S/c1-2-16-12-17-21(24-10-5-14-3-4-18-19(11-14)28-13-27-18)25-20(26-22(17)29-16)15-6-8-23-9-7-15/h3-4,6-9,11-12H,2,5,10,13H2,1H3,(H,24,25,26)