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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-6-nitro-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-6-nitro-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-6-nitro-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-6-nitrothieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-chloro-6-nitro-thieno[2,3-d]pyrimidin-4-yl)-homopiperonyl-amine Formula: C15H11ClN4O4S MolecularWeight: 378.79024

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC3=C4C=C(SC4=NC(=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC3=C4C=C(SC4=NC(=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN4O4S/c16-15-18-13(9-6-12(20(21)22)25-14(9)19-15)17-4-3-8-1-2-10-11(5-8)24-7-23-10/h1-2,5-6H,3-4,7H2,(H,17,18,19)