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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloranyl-2-imidazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-imidazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-(1-imidazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-imidazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-chloro-2-imidazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-piperonyl-amine Formula: C17H12ClN5O2S MolecularWeight: 385.82748

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C4C(=CSC4=NC(=N3)N5C=CN=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C4C(=CSC4=NC(=N3)N5C=CN=C5)Cl

InChI

InChI=1S/C17H12ClN5O2S/c18-11-7-26-16-14(11)15(21-17(22-16)23-4-3-19-8-23)20-6-10-1-2-12-13(5-10)25-9-24-12/h1-5,7-8H,6,9H2,(H,20,21,22)