5-(1,3-benzodioxol-5-ylmethylamino)-3-chloranyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylamino)-3-chloranyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-(1,3-benzodioxol-5-ylmethylamino)-3-chloro-isothiazole-4-carbonitrile CAS Name: 5-(1,3-benzodioxol-5-ylmethylamino)-3-chloro-4-isothiazolecarbonitrile IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylamino)-3-chloro-1,2-thiazole-4-carbonitrile Traditional Name: 3-chloro-5-(piperonylamino)isothiazole-4-carbonitrile Formula: C12H8ClN3O2S MolecularWeight: 293.72882

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C12H8ClN3O2S/c13-11-8(4-14)12(19-16-11)15-5-7-1-2-9-10(3-7)18-6-17-9/h1-3,15H,5-6H2