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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-ethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-ethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-ethyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-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]-piperonyl-amine Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C3=CN=CC=C3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C3=CN=CC=C3)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18N4O2S/c1-2-15-9-16-20(23-10-13-5-6-17-18(8-13)27-12-26-17)24-19(25-21(16)28-15)14-4-3-7-22-11-14/h3-9,11H,2,10,12H2,1H3,(H,23,24,25)