3-methyl-N-[(5-nitrofuran-2-yl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: 3-methyl-N-[(5-nitrofuran-2-yl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: 3-methyl-N-[(5-nitro-2-furyl)methyl]-1,1-dioxo-thiolan-3-amine CAS Name: 3-methyl-N-[(5-nitro-2-furanyl)methyl]-1,1-dioxo-3-thiolanamine IUPAC Name: 3-methyl-N-[(5-nitrofuran-2-yl)methyl]-1,1-dioxothiolan-3-amine Traditional Name: (1,1-diketo-3-methyl-thiolan-3-yl)-[(5-nitro-2-furyl)methyl]amine Formula: C10H14N2O5S MolecularWeight: 274.29356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NCC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O5S/c1-10(4-5-18(15,16)7-10)11-6-8-2-3-9(17-8)12(13)14/h2-3,11H,4-7H2,1H3