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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloranyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-2-pyridin-4-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-2-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-chloro-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-homopiperonyl-amine Formula: C20H15ClN4O2S MolecularWeight: 410.8767

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC3=C4C=C(SC4=NC(=N3)C5=CC=NC=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC3=C4C=C(SC4=NC(=N3)C5=CC=NC=C5)Cl

InChI

InChI=1S/C20H15ClN4O2S/c21-17-10-14-19(23-8-3-12-1-2-15-16(9-12)27-11-26-15)24-18(25-20(14)28-17)13-4-6-22-7-5-13/h1-2,4-7,9-10H,3,8,11H2,(H,23,24,25)