N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-(5-tert-butyl-4-methyl-thiazol-2-yl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-(5-tert-butyl-4-methyl-2-thiazolyl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-(5-tert-butyl-4-methyl-thiazol-2-yl)-N-[2-(1,3-dioxolan-2-yl)ethyl]-3-nitro-benzenesulfonamide Formula: C19H25N3O6S2 MolecularWeight: 455.5483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N(CCC2OCCO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CC1=C(SC(=N1)N(CCC2OCCO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C19H25N3O6S2/c1-13-17(19(2,3)4)29-18(20-13)21(9-8-16-27-10-11-28-16)30(25,26)15-7-5-6-14(12-15)22(23)24/h5-7,12,16H,8-11H2,1-4H3