N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methyl-benzenesulfonamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methyl-benzenesulfonamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methylbenzenesulfonamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methylbenzenesulfonamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-methyl-benzenesulfonamide Formula: C15H13N3O5S2 MolecularWeight: 379.41082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13N3O5S2/c1-9-3-5-11(6-4-9)25(21,22)17-15-16-14-12(23-2)7-10(18(19)20)8-13(14)24-15/h3-8H,1-2H3,(H,16,17)