2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloranyl-pyrimidin-4-amine

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloranyl-pyrimidin-4-amine Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloro-pyrimidin-4-amine CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-6-chloro-4-pyrimidinamine IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-chloropyrimidin-4-amine Traditional Name: [6-chloro-2-(piperonylthio)pyrimidin-4-yl]amine Formula: C12H10ClN3O2S MolecularWeight: 295.7447

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NC(=CC(=N3)Cl)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NC(=CC(=N3)Cl)N

InChI

InChI=1S/C12H10ClN3O2S/c13-10-4-11(14)16-12(15-10)19-5-7-1-2-8-9(3-7)18-6-17-8/h1-4H,5-6H2,(H2,14,15,16)