3-(furan-2-ylmethylsulfanyl)-3-(3-nitrophenyl)-1-pyridin-3-yl-propan-1-one

Systemtic Name: 3-(furan-2-ylmethylsulfanyl)-3-(3-nitrophenyl)-1-pyridin-3-yl-propan-1-one Openeye Name: 3-(2-furylmethylsulfanyl)-3-(3-nitrophenyl)-1-(3-pyridyl)propan-1-one CAS Name: 3-(2-furanylmethylthio)-3-(3-nitrophenyl)-1-(3-pyridinyl)-1-propanone IUPAC Name: 3-(furan-2-ylmethylsulfanyl)-3-(3-nitrophenyl)-1-pyridin-3-ylpropan-1-one Traditional Name: 3-(2-furfurylthio)-3-(3-nitrophenyl)-1-(3-pyridyl)propan-1-one Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)C2=CN=CC=C2)SCC3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)C2=CN=CC=C2)SCC3=CC=CO3

InChI

InChI=1S/C19H16N2O4S/c22-18(15-5-2-8-20-12-15)11-19(26-13-17-7-3-9-25-17)14-4-1-6-16(10-14)21(23)24/h1-10,12,19H,11,13H2