N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-ethyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-ethyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-ethyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-ethyl-2-(2-pyrazinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-ethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(6-ethyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C3=NC=CN=C3)NCC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C3=NC=CN=C3)NCC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H19N5O2S/c1-2-14-10-15-19(24-11-13-3-4-17-18(9-13)28-8-7-27-17)25-20(26-21(15)29-14)16-12-22-5-6-23-16/h3-6,9-10,12H,2,7-8,11H2,1H3,(H,24,25,26)