4-(4-bromanylpyrazol-1-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C16H16BrN5OS MolecularWeight: 406.30014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C16H16BrN5OS/c1-2-3-4-14-20-21-16(24-14)19-15(23)11-5-7-13(8-6-11)22-10-12(17)9-18-22/h5-10H,2-4H2,1H3,(H,19,21,23)