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

Systemtic Name: 4-chloranyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C14H10ClN3O4S2 MolecularWeight: 383.8299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN3O4S2/c1-8-3-2-4-12-13(8)16-14(23-12)17-24(21,22)9-5-6-10(15)11(7-9)18(19)20/h2-7H,1H3,(H,16,17)