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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloranyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chlorothieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-chlorothieno[2,3-d]pyrimidin-4-yl)-homopiperonyl-amine Formula: C15H12ClN3O2S MolecularWeight: 333.79268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O2S/c16-13-6-10-14(18-7-19-15(10)22-13)17-4-3-9-1-2-11-12(5-9)21-8-20-11/h1-2,5-7H,3-4,8H2,(H,17,18,19)