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

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-[(4-bromophenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-[(4-bromophenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(brosylamino)propionamide Formula: C16H21BrN4O3S2 MolecularWeight: 461.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H21BrN4O3S2/c1-2-3-4-5-15-20-21-16(25-15)19-14(22)10-11-18-26(23,24)13-8-6-12(17)7-9-13/h6-9,18H,2-5,10-11H2,1H3,(H,19,21,22)