2-(2,4-dinitrophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2,4-dinitrophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2,4-dinitrophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(2,4-dinitrophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2,4-dinitrophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2,4-dinitrophenyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C16H12N4O7S2 MolecularWeight: 436.41908

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O7S2/c1-29(26,27)11-4-5-12-14(8-11)28-16(17-12)18-15(21)6-9-2-3-10(19(22)23)7-13(9)20(24)25/h2-5,7-8H,6H2,1H3,(H,17,18,21)