N-(4-tert-butyl-1,3-thiazol-2-yl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide Formula: C21H22N4O6S2 MolecularWeight: 490.55258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N4O6S2/c1-21(2,3)18-12-32-20(22-18)23-19(26)13-5-8-15(9-6-13)33(29,30)24-16-11-14(25(27)28)7-10-17(16)31-4/h5-12,24H,1-4H3,(H,22,23,26)