2-chloranyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-nitro-benzamide Openeye Name: 2-chloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-nitro-benzamide CAS Name: 2-chloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-nitrobenzamide IUPAC Name: 2-chloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-nitrobenzamide Traditional Name: 2-chloro-N-(6-mesyl-1,3-benzothiazol-2-yl)-5-nitro-benzamide Formula: C15H10ClN3O5S2 MolecularWeight: 411.84

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10ClN3O5S2/c1-26(23,24)9-3-5-12-13(7-9)25-15(17-12)18-14(20)10-6-8(19(21)22)2-4-11(10)16/h2-7H,1H3,(H,17,18,20)