N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-4-nitro-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine Traditional Name: (1,1-diketothiolan-3-yl)-methyl-(7-nitro-6-pyrrolidino-benzofurazan-4-yl)amine Formula: C15H19N5O5S MolecularWeight: 381.40686

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C15H19N5O5S/c1-18(10-4-7-26(23,24)9-10)11-8-12(19-5-2-3-6-19)15(20(21)22)14-13(11)16-25-17-14/h8,10H,2-7,9H2,1H3