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

Systemtic Name: 2-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[2-(2-methylthiazol-4-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[2-(2-methyl-4-thiazolyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-[2-(2-methylthiazol-4-yl)ethyl]-4-nitro-benzenesulfonamide Formula: C13H15N3O4S2 MolecularWeight: 341.4059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CSC(=N2)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CSC(=N2)C

InChI

InChI=1S/C13H15N3O4S2/c1-9-7-12(16(17)18)3-4-13(9)22(19,20)14-6-5-11-8-21-10(2)15-11/h3-4,7-8,14H,5-6H2,1-2H3