5-chloranyl-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[[3-(2-furylmethoxymethyl)phenyl]methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[[3-(2-furanylmethoxymethyl)phenyl]methyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-(2-furfuryloxymethyl)benzyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCC2=CC(=CC=C2)COCC3=CC=CO3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCC2=CC(=CC=C2)COCC3=CC=CO3)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-27-19-22-10-16(20)17(23-19)18(24)21-9-13-4-2-5-14(8-13)11-25-12-15-6-3-7-26-15/h2-8,10H,9,11-12H2,1H3,(H,21,24)