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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-ethyl-2-(3-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=CN=CC=C3)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

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

InChI

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