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

Systemtic Name: 4-tert-butyl-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-tert-butyl-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-tert-butyl-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-tert-butyl-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-tert-butyl-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H31N3OS/c1-5-6-7-8-9-10-11-18-23-24-20(26-18)22-19(25)16-12-14-17(15-13-16)21(2,3)4/h12-15H,5-11H2,1-4H3,(H,22,24,25)