N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[1-(furan-2-carbonyl)-4-piperidyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[1-(2-furoyl)-4-piperidyl]-4-(methylthio)-3-nitro-benzamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-27-16-5-4-12(11-14(16)21(24)25)17(22)19-13-6-8-20(9-7-13)18(23)15-3-2-10-26-15/h2-5,10-11,13H,6-9H2,1H3,(H,19,22)