N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-5-nitro-benzenesulfonamide Formula: C15H13N3O4S2 MolecularWeight: 363.41142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H13N3O4S2/c1-10-6-7-11(18(19)20)8-14(10)24(21,22)16-9-15-17-12-4-2-3-5-13(12)23-15/h2-8,16H,9H2,1H3