N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-1-(2-nitrophenyl)methanesulfonamide

Systemtic Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-1-(2-nitrophenyl)methanesulfonamide Openeye Name: N-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethyl]-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethyl]-1-(2-nitrophenyl)methanesulfonamide IUPAC Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethyl]-1-(2-nitrophenyl)methanesulfonamide Formula: C17H23N3O5S2 MolecularWeight: 413.51162

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CSCCNS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=C(O1)CSCCNS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O5S2/c1-19(2)11-15-7-8-16(25-15)12-26-10-9-18-27(23,24)13-14-5-3-4-6-17(14)20(21)22/h3-8,18H,9-13H2,1-2H3