4-tert-butyl-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[4-(1-cyanocyclopentyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-(1-cyanocyclopentyl)phenyl]thiocarbamoyl]benzamide Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3(CCCC3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3(CCCC3)C#N

InChI

InChI=1S/C24H27N3OS/c1-23(2,3)18-8-6-17(7-9-18)21(28)27-22(29)26-20-12-10-19(11-13-20)24(16-25)14-4-5-15-24/h6-13H,4-5,14-15H2,1-3H3,(H2,26,27,28,29)