4-bromanyl-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-bromanyl-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-bromo-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-bromo-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-bromo-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-bromo-N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C16H20BrN3OS MolecularWeight: 382.3185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H20BrN3OS/c1-2-3-4-5-6-7-14-19-20-16(22-14)18-15(21)12-8-10-13(17)11-9-12/h8-11H,2-7H2,1H3,(H,18,20,21)