N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C20H21N5O5S2 MolecularWeight: 475.54124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S2/c1-3-4-5-18-22-23-20(31-18)21-19(26)14-7-9-15(10-8-14)24-32(29,30)16-11-6-13(2)17(12-16)25(27)28/h6-12,24H,3-5H2,1-2H3,(H,21,23,26)