N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-(methylthio)pyrimidine-5-carboxamide Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C(=O)NC2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC1=NC=C(C=N1)C(=O)NC2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H15N3O4S/c1-27-19-20-9-12(10-21-19)18(23)22-13-2-4-14(5-3-13)26-15-6-7-16-17(8-15)25-11-24-16/h2-10H,11H2,1H3,(H,22,23)