N-(1,3-benzodioxol-5-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(2-pyrimidylthio)acetamide Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C13H11N3O3S/c17-12(7-20-13-14-4-1-5-15-13)16-9-2-3-10-11(6-9)19-8-18-10/h1-6H,7-8H2,(H,16,17)