N-[1-(furan-3-ylcarbonyl)piperidin-4-yl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[1-(furan-3-ylcarbonyl)piperidin-4-yl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[1-(furan-3-carbonyl)-4-piperidyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[1-[3-furanyl(oxo)methyl]-4-piperidinyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[1-(3-furoyl)-4-piperidyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=COC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=COC=C3

InChI

InChI=1S/C18H19N3O5S/c22-17(12-27-16-3-1-15(2-4-16)21(24)25)19-14-5-8-20(9-6-14)18(23)13-7-10-26-11-13/h1-4,7,10-11,14H,5-6,8-9,12H2,(H,19,22)