4-[(3-nitrophenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S2/c1-2-3-4-8-18-22-23-20(31-18)21-19(26)14-9-11-15(12-10-14)24-32(29,30)17-7-5-6-16(13-17)25(27)28/h5-7,9-13,24H,2-4,8H2,1H3,(H,21,23,26)