5-chloranyl-N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H15Cl2N3O3S MolecularWeight: 400.2796

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCCC2=CC3=C(C(=C2)Cl)OCCO3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCCC2=CC3=C(C(=C2)Cl)OCCO3)Cl

InChI

InChI=1S/C16H15Cl2N3O3S/c1-25-16-20-8-11(18)13(21-16)15(22)19-3-2-9-6-10(17)14-12(7-9)23-4-5-24-14/h6-8H,2-5H2,1H3,(H,19,22)